Trabajos de Antonio Frontera

Chemistry


  Listando 248 trabajos del autor/autora 39
Lista de trabajos en el área Chemistry
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Article A "nucleophilic'' iodine in a halogen-bonded iodonium complex manifests an unprecedented I+ center dot center dot center dot Ag+ interaction Yu, Shilin; Kumar, Parveen; Ward, Jas S.; Frontera, Antonio; Rissanen, Kari CHEM 2451-9294 (2021) DOI / 10.1016/j.chempr.2021.01.003
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Article NO3- anions can act as Lewis acid in the solid state Bauza, Antonio; Frontera, Antonio; Mooibroek, Tiddo J. NATURE COMMUNICATIONS (2017) DOI / 10.1038/ncomms14522 Green published, Gold, Green submitted
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Article Supramolecular Assemblies in Pb(II) Complexes with Hydrazido-Based Ligands Mahmoudi, Ghodrat; Seth, Saikat Kumar; Zubkov, Fedor, I; Lopez-Torres, Elena; Bacchi, Alessia; Stilinovic, Vladimir; Frontera, Antonio CRYSTALS (2019) DOI / 10.3390/cryst9060323 Gold DOAJ, Green published
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Article Asymmetric [N-I-N](+)halonium complexes Ward, Jas S.; Fiorini, Giorgia; Frontera, Antonio; Rissanen, Kari CHEMICAL COMMUNICATIONS 1359-7345 (2020) DOI / 10.1039/d0cc02758h Gold other, Green published
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Article Diastereoselective Amplification of a Mechanically Chiral [2]Catenane Caprice, Kenji; Pal, David; Besnard, Celine; Galmes, Bartomeu; Frontera, Antonio; Cougnon, Fabien B. L. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 0002-7863 (2021) DOI / 10.1021/jacs.1c06557 Green published, Hybrid
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Article Halogen bonding effects on the outcome of reactions at metal centres Carreras, Lucas; Benet-Buchholz, Jordi; Franconetti, Antonio; Frontera, Antonio; van Leeuwen, Piet W. N. M.; Vidal-Ferran, Anton CHEMICAL COMMUNICATIONS 1359-7345 (2019) DOI / 10.1039/c8cc08884e Green accepted
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Article Molecular Electrostatic Potential and Noncovalent Interactions in Derivatives of Group 8 Elements Daolio, Andrea; Pizzi, Andrea; Calabrese, Miriam; Terraneo, Giancarlo; Bordignon, Simone; Frontera, Antonio; Resnati, Giuseppe ANGEWANDTE CHEMIE-INTERNATIONAL EDITION 1433-7851 (2021) DOI / 10.1002/anie.202107978 Hybrid, Green published
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Article A facile biomimetic catalytic activity through hydrogen atom abstraction by the secondary coordination sphere in manganese(III) complexes Jana, Narayan Ch.; Brandao, Paula; Frontera, Antonio; Panja, Anangamohan DALTON TRANSACTIONS 1477-9226 (2020) DOI / 10.1039/d0dt02431g
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Article Interconvertible Hydrochlorothiazide-Caffeine Multicomponent Pharmaceutical Materials: A Solvent Issue Verdugo-Escamilla, Cristobal; Alarcon-Payer, Carolina; Frontera, Antonio; Javier Acebedo-Martinez, Francisco; Dominguez-Martin, Alicia; Gomez-Morales, Jaime; Choquesillo-Lazarte, Duane CRYSTALS (2020) DOI / 10.3390/cryst10121088 Gold other, Green published
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Article Regium-pi bonds: An Unexplored Link between Noble Metal Nanoparticles and Aromatic Surfaces Frontera, Antonio; Bauza, Antonio CHEMISTRY-A EUROPEAN JOURNAL 0947-6539 (2018) DOI / 10.1002/chem.201800820
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Article Ultrashort H delta+center dot center dot center dot H delta- intermolecular distance in a supramolecular system in the solid state Garcia-Marquez, Alfonso; Frontera, Antonio; Roisnel, Thierry; Gramage-Doria, Rafael CHEMICAL COMMUNICATIONS 1359-7345 (2021) DOI / 10.1039/d1cc02143e
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Article Spodium Bonds: Noncovalent Interactions Involving Group 12 Elements Bauza, Antonio; Alkorta, Ibon; Elguero, Jose; Mooibroek, Tiddo J.; Frontera, Antonio ANGEWANDTE CHEMIE-INTERNATIONAL EDITION 1433-7851 (2020) DOI / 10.1002/anie.202007814
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Article Benzyl Dihydrazone versus Thiosemicarbazone Schiff Base: Effects on the Supramolecular Arrangement of Cobalt Thiocyanate Complexes and the Generation of CoN6 and CoN4S2 Coordination Spheres Mahmoudi, Ghodrat; Zareba, Jan K.; Gurbanov, Atash V.; Bauza, Antonio; Zubkov, Fedor I.; Kubicki, Maciej; Stilinovic, Vladimir; Kinzhybalo, Vasyl; Frontera, Antonio EUROPEAN JOURNAL OF INORGANIC CHEMISTRY 1434-1948 (2017) DOI / 10.1002/ejic.201700955
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Article Pnictogen-bonding catalysis: brevetoxin-type polyether cyclizations Gini, Andrea; Paraja, Miguel; Galmes, Bartomeu; Besnard, Celine; Poblador-Bahamonde, Amalia, I; Sakai, Naomi; Frontera, Antonio; Matile, Stefan CHEMICAL SCIENCE 2041-6520 (2020) DOI / 10.1039/d0sc02551h Gold DOAJ, Green published
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Article Pseudohalides regulated diverse helicity in copper(II) coordination polymers derived from a bis(aminoethoxy) ligand Jana, Narayan Ch.; Pramanik, Kuheli; Bauza, Antonio; Brandao, Paula; Patra, Moumita; Frontera, Antonio; Panja, Anangamohan POLYHEDRON 0277-5387 (2017) DOI / 10.1016/j.poly.2016.12.042
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Review Not Only Hydrogen Bonds: Other Noncovalent Interactions Alkorta, Ibon; Elguero, Jose; Frontera, Antonio CRYSTALS (2020) DOI / 10.3390/cryst10030180 Gold DOAJ
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Article Host-guest complexes vs. supramolecular polymers in chalcogen bonding receptors: an experimental and theoretical study Navarro-Garcia, Encarnacion; Galmes, Bartomeu; Luis Esquivel, Jose; Velasco, Maria D.; Bastida, Adolfo; Zapata, Fabiola; Caballero, Antonio; Frontera, Antonio DALTON TRANSACTIONS (2021) DOI / 10.1039/d1dt03925c
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Article Anion-Cation Recognition Pattern, Thermal Stability and DFT-Calculations in the Crystal Structure of H(2)dap[Cd(HEDTA)(H2O)] Salt (H(2)dap = H-2(N3,N7)-2,6-Diaminopurinium Cation) Carolina Belmont-Sanchez, Jeannette; Ruiz-Gonzalez, Noelia; Frontera, Antonio; Matilla-Hernandez, Antonio; Castineiras, Alfonso; Niclos-Gutierrez, Juan CRYSTALS (2020) DOI / 10.3390/cryst10040304 Gold DOAJ, Green published
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Article On the importance of pi-hole spodium bonding in tricoordinated Hg-II complexes Mahmoudi, Ghodrat; Masoudiasl, Ardavan; Babashkina, Maria G.; Frontera, Antonio; Doert, Thomas; White, Jonathan M.; Zangrando, Ennio; Zubkov, Fedor I.; Safin, Damir A. DALTON TRANSACTIONS 1477-9226 (2020) DOI / 10.1039/d0dt03938a
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Article Synchronized On/Off Switching of Four Binding Sites for Water in a Molecular Solomon Link Caprice, Kenji; Pupier, Marion; Bauza, Antonio; Frontera, Antonio; Cougnon, Fabien B. L. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION 1433-7851 (2019) DOI / 10.1002/anie.201902278
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Article Both end-on and end-to-end azide bridged tetranuclear ferromagnetic nickel(II) Schiff base complexes Bhattacharyya, Anik; Das, Mithun; Bauza, Antonio; Herrero, Santiago; Gonzalez-Prieto, Rodrigo; Frontera, Antonio; Chattopadhyay, Shouvik NEW JOURNAL OF CHEMISTRY 1144-0546 (2017) DOI / 10.1039/c7nj00852j
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Article Anion...Anion Interactions Involving sigma-Holes of Perrhenate, Pertechnetate and Permanganate Anions Daolio, Andrea; Pizzi, Andrea; Terraneo, Giancarlo; Frontera, Antonio; Resnati, Giuseppe CHEMPHYSCHEM 1439-4235 (2021) DOI / 10.1002/cphc.202100681
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Review Metal Centers as Nucleophiles: Oxymoron of Halogen Bond-Involving Crystal Engineering Ivanov, Daniil M.; Bokach, Nadezhda A.; Yu. Kukushkin, Vadim; Frontera, Antonio CHEMISTRY-A EUROPEAN JOURNAL 0947-6539 (2021) DOI / 10.1002/chem.202103173 Hybrid
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Article Selective functionalisation of aromatic alcohols with supramolecularly regulated gold(i) catalysts Carreras, Lucas; Franconetti, Antonio; Grabulosa, Arnald; Frontera, Antonio; Vidal-Ferran, Anton ORGANIC CHEMISTRY FRONTIERS 2052-4129 (2020) DOI / 10.1039/d0qo00416b
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Article Macrocyclic complexes based on [NMIDLINE HORIZONTAL ELLIPSISIMIDLINE HORIZONTAL ELLIPSISN](+) halogen bonds Yu, Shilin; Kalenius, Elina; Frontera, Antonio; Rissanen, Kari CHEMICAL COMMUNICATIONS 1359-7345 (2021) DOI / 10.1039/d1cc05616f Hybrid
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Article Iodonium complexes of the tertiary amines quinuclidine and 1-ethylpiperidine Ward, Jas S.; Frontera, Antonio; Rissanen, Kari DALTON TRANSACTIONS 1477-9226 (2021) DOI / 10.1039/d1dt01437d Gold other
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Article The role of pi-pi stacking and hydrogen-bonding interactions in the assembly of a series of isostructural group IIB coordination compounds Hajiashrafi, Taraneh; Zekriazadeh, Roghayeh; Flanagan, Keith J.; Kia, Farnoush; Bauza, Antonio; Frontera, Antonio; Senge, Mathias O. ACTA CRYSTALLOGRAPHICA SECTION C-STRUCTURAL CHEMISTRY 0108-2701 (2019) DOI / 10.1107/s2053229618018314 Green published, Gold other
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Article Ni-Catalysed Intramolecular [4+4]-cycloadditions of bis-dienes towards eight-membered fused bicyclic systems: a combined experimental and computational study Llorente, Nuria; Fernandez-Perez, Hector; Bauza, Antonio; Frontera, Antonio; Vidal-Ferran, Anton CATALYSIS SCIENCE & TECHNOLOGY 2044-4753 (2018) DOI / 10.1039/c8cy00684a Green accepted
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Article Unprecedented [d(9)]CuMIDLINE HORIZONTAL ELLIPSIS[d(10)]Au coinage bonding interactions in {Cu(NH3)(4)[Au(CN)(2)]}(+)[Au(CN)(2)](-) salt Priola, Emanuele; Mahmoudi, Ghodrat; Andreo, Jacopo; Frontera, Antonio CHEMICAL COMMUNICATIONS 1359-7345 (2021) DOI / 10.1039/d1cc02709c Green submitted
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Article Spodium Bonds in Biological Systems: Expanding the Role of Zn in Protein Structure and Function Biswal, Himansu S.; Sahu, Akshay Kumar; Frontera, Antonio; Bauza, Antonio JOURNAL OF CHEMICAL INFORMATION AND MODELING 1549-9596 (2021) DOI / 10.1021/acs.jcim.1c00594 Green published
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Article H-Bonded anion-anion complexes in fentanyl citrate polymorphs and solvates Barbas, Rafael; Prohens, Rafel; Bauza, Antonio; Franconetti, Antonio; Frontera, Antonio CHEMICAL COMMUNICATIONS 1359-7345 (2019) DOI / 10.1039/c8cc09028a
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Article A Strategy to Synthesize Molecular Knots and Links Using the Hydrophobic Effect Cougnon, Fabien B. L.; Caprice, Kenji; Pupier, Marion; Bauza, Antonio; Frontera, Antonio JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 0002-7863 (2018) DOI / 10.1021/jacs.8b05220
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Article Naphthalenediimides with Cyclic Oligochalcogenides in Their Core Shybeka, Inga; Aster, Alexander; Cheng, Yangyang; Sakai, Naomi; Frontera, Antonio; Vauthey, Eric; Matile, Stefan CHEMISTRY-A EUROPEAN JOURNAL 0947-6539 (2020) DOI / 10.1002/chem.202003550
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Article Using Room Temperature Phosphorescence of Gold(I) Complexes for PAHs Sensing Rosental, Marian; Coldman, Richard N.; Moro, Artur J.; Angurell, Inmaculada; Gomila, Rosa M.; Frontera, Antonio; Lima, Joao Carlos; Rodriguez, Laura MOLECULES (2021) DOI / 10.3390/molecules26092444 Gold DOAJ
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Article Anion Anion Coinage Bonds: The Case of Tetrachloridoaurate Daolio, Andrea; Pizzi, Andrea; Terraneo, Giancarlo; Ursini, Maurizio; Frontera, Antonio; Resnati, Giuseppe ANGEWANDTE CHEMIE-INTERNATIONAL EDITION 1433-7851 (2021) DOI / 10.1002/anie.202104592 Gold other
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Article Electron belt-to-sigma-hole switch of noncovalently bound iodine(I) atoms in dithiocarbamate metal complexes Zelenkov, Lev E.; Eliseeva, Anastasiya A.; Baykov, Sergey V.; Suslonov, Vitalii V.; Galmes, Bartomeu; Frontera, Antonio; Kukushkin, Vadim Yu.; Ivanov, Daniil M.; Bokach, Nadezhda A. INORGANIC CHEMISTRY FRONTIERS 2052-1553 (2021) DOI / 10.1039/d1qi00314c
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Article Ligand Steric Hindrances Switch Bridging (mu(2)-I)center dot center dot center dot O,O to Two-Center I center dot center dot center dot O Halogen-Bonding Mode in the Assembly of Diketonate Copper(II) Species Rozhkov, Anton, V; Ananyev, Ivan, V; Petrov, Aleksandr A.; Galmes, Bartomeu; Frontera, Antonio; Bokach, Nadezhda A.; Kukushkin, Vadim Yu CRYSTAL GROWTH & DESIGN 1528-7483 (2021) DOI / 10.1021/acs.cgd.1c00373
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Article 9-Ethyladenine: Mechanochemical Synthesis, Characterization, and DFT Calculations of Novel Cocrystals and Salts Rosello, Yannick; Benito, Monica; Bagues, Nuria; Martinez, Nuria; Moradell, Alba; Mata, Ignasi; Galcera, Judit; Barcelo-Oliver, Miquel; Frontera, Antonio; Molins, Elies CRYSTAL GROWTH & DESIGN 1528-7483 (2020) DOI / 10.1021/acs.cgd.9b01628
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Article Oxalato bridged coordination polymer of manganese(iii) involving unconventional OMIDLINE HORIZONTAL ELLIPSIS pi-hole(nitrile) and antiparallel nitrileMIDLINE HORIZONTAL ELLIPSISnitrile contacts: antiproliferative evaluation and theoretical studies Dutta, Debajit; Sharma, Pranay; Frontera, Antonio; Gogoi, Anshuman; Verma, Akalesh K.; Dutta, Diksha; Sarma, Bipul; Bhattacharyya, Manjit K. NEW JOURNAL OF CHEMISTRY 1144-0546 (2020) DOI / 10.1039/d0nj03712e
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Article Dual role of silver in a fluorogenic N-squaraine probe based on Ag(I)-pi interactions Vega, Manel; Blasco, Salvador; Garcia-Espana, Enrique; Soberats, Bartolome; Frontera, Antonio; Rotger, Carmen; Costa, Antonio DALTON TRANSACTIONS 1477-9226 (2021) DOI / 10.1039/d1dt01408k
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Article On the nature of recurrent Au center dot center dot center dot pi motifs in tris(2,2 '-bipyridine)M(II) (M = Fe, Co and Ni) dicyanoaurate(I) salts: X-ray analysis and theoretical rationalization Priola, Emanuele; Giordana, Alessia; Mazzeo, Paolo P.; Mahmoudi, Ghodrat; Gomila, Rosa M.; Zubkov, Fedor, I; Pokazeev, Kuzma M.; Valchuk, Karina S.; Bacchi, Alessia; Zangrando, Ennio; Frontera, Antonio DALTON TRANSACTIONS 1477-9226 (2021) DOI / 10.1039/d1dt02632a Green submitted
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Article Dangling and Hydrolyzed Ligand Arms in [Mn-3] and [Mn-6] Coordination Assemblies: Synthesis, Characterization, and Functional Activity Chattopadhyay, Krishna; Craig, Gavin A.; Ojea, Maria Jose Heras; Pait, Moumita; Kundu, Animesh; Lee, Junseong; Murrie, Mark; Frontera, Antonio; Ray, Debashis INORGANIC CHEMISTRY 0020-1669 (2017) DOI / 10.1021/acs.inorgchem.6b02813 Green accepted
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Article A theoretical insight on the anion center dot center dot center dot anion interactions observed in the solid state structure of a hetero-trinuclear complex Ghosh, Kousik; Frontera, Antonio; Chattopadhyay, Shouvik CRYSTENGCOMM (2021) DOI / 10.1039/d0ce01513j
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Article Insight into non-covalent interactions in two triamine-based mononuclear iron(III) Schiff base complexes with special emphasis on the formation of Br center dot center dot center dot pi halogen bonding Basak, Tanmoy; Frontera, Antonio; Chattopadhyay, Shouvik CRYSTENGCOMM (2021) DOI / 10.1039/d0ce01534b
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Article Synergistic Anion-(pi)(n)-pi Catalysis on pi-Stacked Foldamers Bornhof, Anna-Bea; Bauza, Antonio; Aster, Alexander; Pupier, Marion; Frontera, Antonio; Vauthey, Eric; Sakai, Naomi; Matile, Stefan JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 0002-7863 (2018) DOI / 10.1021/jacs.8b00809 Hybrid, Green published
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Article On the Role of Water as a Catalyst in Prebiotic Chemistry Saa, Jose M.; Frontera, Antonio CHEMPHYSCHEM 1439-4235 (2020) DOI / 10.1002/cphc.201901069
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Article On the supramolecular properties of neutral, anionic and cationic cadmium complexes harvested from dithiolate-polyamine binary ligand systems Adhikari, Suman; Bhattacharjee, Tirtha; Das, Arijit; Roy, Subhadip; Daniliuc, Constantin Gabriel; Zareba, Jan K.; Bauza, Antonio; Frontera, Antonio CRYSTENGCOMM (2020) DOI / 10.1039/d0ce01233e
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Article Theoretical ab Initio Study on Cooperativity Effects between Nitro -hole and Halogen Bonding Interactions Galmes, Bartomeu; Martinez, Daniel; Infante-Carrio, Maria F.; Franconetti, Antonio; Frontera, Antonio CHEMPHYSCHEM 1439-4235 (2019) DOI / 10.1002/cphc.201900142
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Article Biologically relevant and energetically significant cooperative ternary (pi-pi)(2)/(pi-pi)(1)/(pi-pi)(2) assemblies and fascinating discrete (H2O)(21) clusters in isostructural 2,5-pyridine dicarboxylato Co(ii) and Zn(ii) phenanthroline compounds: antiprol Chetry, Sanjib; Sharma, Pranay; Frontera, Antonio; Saha, Utpal; Verma, Akalesh K.; Sarma, Bipul; Kalita, Paran Jyoti; Bhattacharyya, Manjit K. NEW JOURNAL OF CHEMISTRY 1144-0546 (2021) DOI / 10.1039/d0nj04338a
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Article Utility of Three-Coordinate Silver Complexes Toward the Formation of Iodonium Ions Ward, Jas S.; Frontera, Antonio; Rissanen, Kari INORGANIC CHEMISTRY 0020-1669 (2021) DOI / 10.1021/acs.inorgchem.1c00409 Gold other, Green published
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Article Synthesis, X-ray characterization and theoretical study of 3a,6:7,9a-diepoxybenzo[de]isoquinoline derivatives: on the importance of FMIDLINE HORIZONTAL ELLIPSISO interactions Grudova, Mariya, V; Gil, Diego M.; Khrustalev, Victor N.; Nikitina, Eugeniya, V; Sinelshchikova, Anna A.; Grigoriev, Mikhail S.; Kletskov, Alexey, V; Frontera, Antonio; Zubkov, Fedor, I NEW JOURNAL OF CHEMISTRY 1144-0546 (2020) DOI / 10.1039/d0nj04328a
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Article A Series of Lanthanide-Based Metal-Organic Frameworks Derived from Furan-2,5-dicarboxylate and Glutarate: Structure-Corroborated Density Functional Theory Study, Magnetocaloric Effect, Slow Relaxation of Magnetization, and Luminescent Properties Kumar, Manesh; Wu, Lin-Hui; Kariem, Mukaddus; Franconetti, Antonio; Sheikh, Haq Nawaz; Liu, Sui-Jun; Sahoo, Subash Chandra; Frontera, Antonio INORGANIC CHEMISTRY 0020-1669 (2019) DOI / 10.1021/acs.inorgchem.9b00219
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Article Controlled scrambling reactions to polyphosphanes via bond metathesis reactions Schoemaker, Robin; Schwedtmann, Kai; Franconetti, Antonio; Frontera, Antonio; Hennersdorf, Felix; Weigand, Jan J. CHEMICAL SCIENCE 2041-6520 (2019) DOI / 10.1039/c9sc04501e Gold, Green published
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Article Bifunctional Fluorophosphonium Triflates as Intramolecular Frustrated Lewis Pairs: Reversible CO2 Sequestration and Binding of Carbonyls, Nitriles and Acetylenes Guo, Chun-xiang; Schwedtmann, Kai; Fidelius, Jannis; Hennersdorf, Felix; Dickschat, Arne; Bauza, Antonio; Frontera, Antonio; Weigand, Jan J. CHEMISTRY-A EUROPEAN JOURNAL 0947-6539 (2021) DOI / 10.1002/chem.202102382 Hybrid
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Article Charge assisted halogen and pnictogen bonds: insights from the Cambridge Structural Database and DFT calculations Gomila, Rosa M.; Frontera, Antonio CRYSTENGCOMM (2020) DOI / 10.1039/d0ce00220h
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Article Sildenafil-Resorcinol Cocrystal: XRPD Structure and DFT Calculations Barbas, Rafael; Kumar, Vineet; Vallcorba, Oriol; Prohens, Rafel; Frontera, Antonio CRYSTALS (2020) DOI / 10.3390/cryst10121126 Gold DOAJ
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Article Short X center dot center dot center dot N Halogen Bonds With Hexamethylenetetraamine as the Acceptor Anyfanti, Goulielmina; Bauza, Antonio; Gentiluomo, Lorenzo; Rodrigues, Joao; Portalone, Gustavo; Frontera, Antonio; Rissanen, Kari; Puttreddy, Rakesh FRONTIERS IN CHEMISTRY 2296-2646 (2021) DOI / 10.3389/fchem.2021.623595 Gold DOAJ, Green published
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Article Importance of Anion-pi Interactions in RNA GAAA and GGAG Tetraloops: A Combined MD and QM Study Esmaeeli, Reza; Nieves Pina, Maria de Las; Frontera, Antonio; Perez, Alberto; Bauza, Antonio JOURNAL OF CHEMICAL THEORY AND COMPUTATION 1549-9618 (2021) DOI / 10.1021/acs.jctc.1c00756 Hybrid, Green published
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Article Metal removal from the secondary building unit of bio-MOF-1 by adenine N6-alkylation while retaining the overall 3D porous topology Garcia-Raso, Angel; Terron, Angel; Rosello, Yannick; Frontera, Antonio; Castillo, Oscar; Beobide, Garikoitz; Perez-Yanez, Sonia; Escudero-Adan, Eduardo C.; Fiol, Juan J. CRYSTENGCOMM (2020) DOI / 10.1039/d0ce00631a
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Article Nitropyridine-1-Oxides as Excellent 7t-Hole Donors: Interplay between o-Hole (Halogen, Hydrogen, Triel, and Coordination Bonds) and pi-Hole Interactions Galmes, Bartomeu; Franconetti, Antonio; Frontera, Antonio INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES 1661-6596 (2019) DOI / 10.3390/ijms20143440 Gold DOAJ, Green published
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Article Theoretical study of spodium bonding in the active site of three Zn-proteins and several model systems Llull, Rosa; Montalban, Gaizca; Vidal, Ivan; Gomila, Rosa M.; Bauza, Antonio; Frontera, Antonio PHYSICAL CHEMISTRY CHEMICAL PHYSICS 1463-9076 (2021) DOI / 10.1039/d1cp02150h
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Article Highly polar stacking interactions wrap inorganics in organics: lone-pair-pi-hole interactions between the PdO4 core and electron-deficient arenes Torubaev, Yury, V; Skabitsky, Ivan, V; Rozhkov, Anton, V; Galmes, Bartomeu; Frontera, Antonio; Kukushkin, Vadim Yu INORGANIC CHEMISTRY FRONTIERS 2052-1553 (2021) DOI / 10.1039/d1qi01067k
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Article Intramolecular Noncovalent Carbon Bonding Interaction Stabilizes the cis Conformation in Acylhydrazones Naseer, Muhammad Moazzam; Hussain, Majid; Bauza, Antonio; Lo, Kong Mun; Frontera, Antonio CHEMPLUSCHEM 2192-6506 (2018) DOI / 10.1002/cplu.201800329
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Article Nucleophilic iodonium interactions (NIIs) in 2-coordinate iodine(i) and silver(i) complexes Ward, Jas S.; Frontera, Antonio; Rissanen, Kari CHEMICAL COMMUNICATIONS 1359-7345 (2021) DOI / 10.1039/d1cc01505b Green published, Gold other
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Review A survey of the different roles of polyoxometalates in their interaction with amino acids, peptides and proteins Arefian, Mina; Mirzaei, Masoud; Eshtiagh-Hosseini, Hossein; Frontera, Antonio DALTON TRANSACTIONS 1477-9226 (2017) DOI / 10.1039/c7dt00894e
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Article Anion-pi Interactions in Hollow Crystals of a Copper(II)-Cyamelurate Coordination Complex Martinez-Benito, Carla; Bauza, Antonio; Lago, Ana B.; Ruiz-Perez, Catalina; Jimenez, Claudio A.; Torres, Manuel E.; Frontera, Antonio; Pasan, Jorge CRYSTAL GROWTH & DESIGN 1528-7483 (2018) DOI / 10.1021/acs.cgd.8b00305
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Article A comparative experimental and theoretical investigation of hydrogen-bond, halogen-bond and pi-pi interactions in the solid-state supramolecular assembly of 2-and 4-formylphenyl arylsulfonates Andleeb, Hina; Khan, Imtiaz; Bauza, Antonio; Tahir, Muhammad Nawaz; Simpson, Jim; Hameed, Shahid; Frontera, Antonio ACTA CRYSTALLOGRAPHICA SECTION C-STRUCTURAL CHEMISTRY 0108-2701 (2018) DOI / 10.1107/s2053229618008355
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Article Modulation of coordination in pincer-type isonicotinohydrazone Schiff base ligands by proton transfer Mahmoudi, Ghodrat; Khandar, Ali Akbar; Afkhami, Farhad Akbari; Miroslaw, Barbara; Gurbanov, Atash V.; Zubkov, Fedor I.; Kennedy, Alan; Franconetti, Antonio; Frontera, Antonio CRYSTENGCOMM (2019) DOI / 10.1039/c8ce01580e Green accepted
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Article Synthesis, X-ray Characterization and Density Functional Theory (DFT) Studies of Two Polymorphs of the alpha,alpha,alpha,alpha, Isomer of Tetra-p-Iodophenyl Tetramethyl Calix[4]pyrrole: On the Importance of Halogen Bonds Dabuleanu, Dragos; Bauza, Antonio; Ortega-Castro, Joaquin; Escudero-Adan, Eduardo C.; Ballester, Pablo; Frontera, Antonio MOLECULES (2020) DOI / 10.3390/molecules25020285 Gold DOAJ, Green accepted, Green published
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Article Nickel(II) complexes based on dithiolate-polyamine binary ligand systems: crystal structures, hirshfeld surface analysis, theoretical study, and catalytic activity study on photocatalytic hydrogen generation Adhikari, Suman; Bhattacharjee, Tirtha; Bhattacharjee, Sharmila; Daniliuc, Constantin Gabriel; Frontera, Antonio; Lopato, Eric M.; Bernhard, Stefan DALTON TRANSACTIONS 1477-9226 (2021) DOI / 10.1039/d1dt00352f
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Article pi-Hole Interactions Involving Nitro Aromatic Ligands in Protein Structures Bauza, Antonio; Frontera, Antonio; Mooibroek, Tiddo Jonathan CHEMISTRY-A EUROPEAN JOURNAL 0947-6539 (2019) DOI / 10.1002/chem.201903404 Green published, Gold other
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Article Crystal engineering with pyrazolyl-thiazole derivatives: structure-directing role of pi-stacking and sigma-hole interactions Ahmed, Muhammad Naeem; Madni, Murtaza; Anjum, Shaista; Andleeb, Saiqa; Hameed, Shahid; Khan, Abdul Majeed; Ashfaq, Muhammad; Tahir, Muhammad Nawaz; Gil, Diego M.; Frontera, Antonio CRYSTENGCOMM (2021) DOI / 10.1039/d1ce00256b
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Article Definition of the chalcogen bond (IUPAC Recommendations 2019) Aakeroy, Christer B.; Bryce, David L.; Desiraju, Gautam; Frontera, Antonio; Legon, Anthony C.; Nicotra, Francesco; Rissanen, Kari; Scheiner, Steve; Terraneo, Giancarlo; Metrangolo, Pierangelo; Resnati, Giuseppe PURE AND APPLIED CHEMISTRY 0033-4545 (2019) DOI / 10.1515/pac-2018-0713 Green accepted, Green published, Gold other
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Article Charge-Assisted Chalcogen Bonds: CSD and DFT Analyses and Biological Implication in Glucosidase Inhibitors Galmes, Bartomeu; Juan-Bals, Aida; Frontera, Antonio; Resnati, Giuseppe CHEMISTRY-A EUROPEAN JOURNAL 0947-6539 (2020) DOI / 10.1002/chem.201905498
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Article Raise the anchor! Synthesis, X-ray and NMR characterization of 1,3,5-triazinanes with an axial tert-butyl group Kletskov, Alexey V.; Zatykina, Anastasya D.; Grudova, Mariya V.; Sinelshchikova, Anna A.; Grigoriev, Mikhail S.; Zaytsev, Vladimir P.; Gil, Diego M.; Novikov, Roman A.; Zubkov, Fedor I.; Frontera, Antonio ORGANIC & BIOMOLECULAR CHEMISTRY 1477-0520 (2020) DOI / 10.1039/d0ob01201g
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Article Theoretical and Crystallographic Study of Lead(IV) Tetrel Bonding Interactions Franconetti, Antonio; Frontera, Antonio CHEMISTRY-A EUROPEAN JOURNAL 0947-6539 (2019) DOI / 10.1002/chem.201900447
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Article Exploration of Br center dot center dot center dot O halogen bonding interactions in dinuclear vanadium(V) complexes with Schiff base ligands Thakur, Snehasish; Gil, Diego M.; Frontera, Antonio; Chattopadhyay, Shouvik POLYHEDRON 0277-5387 (2020) DOI / 10.1016/j.poly.2020.114676
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Article An experimental and theoretical exploration of supramolecular interactions and photoresponse properties of two Ni(II) complexes Pramanik, Samit; Pathak, Sudipta; Jana, Sumanta; Mondal, Monotosh; Frontera, Antonio; Mukhopadhyay, Subrata NEW JOURNAL OF CHEMISTRY 1144-0546 (2021) DOI / 10.1039/d1nj01363g
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Article X-ray characterization, Hirshfeld surface analysis, DFT calculations, in vitro and in silico lipoxygenase inhibition (LOX) studies of dichlorophenyl substituted 3-hydroxy-chromenones Ahmed, Muhammad Naeem; Ghias, Mehreen; Shah, Syed Wadood Ali; Shoaib, Mohammad; Tahir, Muhammad Nawaz; Ashfaq, Muhammad; Ibrahim, Mahmoud A. A.; Andleeb, Hina; Gil, Diego M.; Frontera, Antonio NEW JOURNAL OF CHEMISTRY 1144-0546 (2021) DOI / 10.1039/d1nj04340d
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Article A Combined Experimental and Theoretical Study on the Formation of a Cyclic Tetrameric Water Cluster and a Similar Type of Cyclic Cluster in Copper(II) Schiff Base Complexes Roy, Sourav; Basak, Tanmoy; Khan, Samim; Drew, Michael G. B.; Bauza, Antonio; Frontera, Antonio; Chattopadhyay, Shouvik CHEMISTRYSELECT 2365-6549 (2017) DOI / 10.1002/slct.201701266
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Article A Combined Experimental and Theoretical Study to Explore the Importance of sigma-Hole Carbon Bonding Interactions in Stabilizing Molecular Assemblies Roy, Sourav; Drew, Michael G. B.; Bauza, Antonio; Frontera, Antonio; Chattopadhyay, Shouvik CHEMISTRYSELECT 2365-6549 (2017) DOI / 10.1002/slct.201702123
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Article Primary Anion-pi Catalysis and Autocatalysis Zhang, Xiang; Hao, Xiaoyu; Liu, LE; Pham, Anh-Tuan; Lopez-Andarias, Javier; Frontera, Antonio; Sakai, Naomi; Matile, Stefan JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 0002-7863 (2018) DOI / 10.1021/jacs.8b11788 Bronze
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Article Unexpected chalcogen bonds in tetravalent sulfur compounds Franconetti, Antonio; Quinonero, David; Frontera, Antonio; Resnati, Giuseppe PHYSICAL CHEMISTRY CHEMICAL PHYSICS 1463-9076 (2019) DOI / 10.1039/c9cp01033e Green submitted
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Article Isolation of Azadiphosphiridines and Diphosphenimines by Cycloaddition of Azides and a Cationic Diphosphene Schwedtmann, Kai; Hennersdorf, Felix; Bauza, Antonio; Frontera, Antonio; Fischer, Roland; Weigand, Jan J. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION 1433-7851 (2017) DOI / 10.1002/anie.201702058
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Review Noble Gas Bonding Interactions Involving Xenon Oxides and Fluorides Frontera, Antonio MOLECULES (2020) DOI / 10.3390/molecules25153419 Gold DOAJ, Green published
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Article Unraveling the dual character of sulfur atoms in a series of Hg(II) coordination polymers containing bis(4-pyridyl) disulfide Tehrani, Alireza Azhdari; Ghasempour, Hosein; Morsali, Ali; Bauza, Antonio; Frontera, Antonio; Retailleau, Pascal CRYSTENGCOMM (2017) DOI / 10.1039/c7ce00033b
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Article On the Importance of Halogen-Halogen Interactions in the Solid State of Fullerene Halides: A Combined Theoretical and Crystallographic Study Bauza, Antonio; Frontera, Antonio CRYSTALS (2017) DOI / 10.3390/cryst7070191 Gold DOAJ
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Article Adsorption and Quantification of Volatile Organic Compounds (VOCs) by using Hybrid Magnetic Nanoparticles de las Nieves Pina, Maria; Rodriguez, Paulina; Gutierrez, Maria Susana; Quinonero, David; Morey, Jeroni; Frontera, Antonio CHEMISTRY-A EUROPEAN JOURNAL 0947-6539 (2018) DOI / 10.1002/chem.201802945
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Article Tetranuclear Mn-II/Zn-II and Novel Azido-Bridged Chair-Shaped Heptanuclear Cd-II Compounds: The Effect of Metal Ion and Coordination Mode of the Azide Group on the Structure of the Products Afkhami, Farhad Akbari; Mahmoudi, Ghodrat; Khandar, Ali Akbar; Franconetti, Antonio; Zangrando, Ennio; Qureshi, Naseem; Lipkowski, Janusz; Gurbanov, Atash V.; Frontera, Antonio EUROPEAN JOURNAL OF INORGANIC CHEMISTRY 1434-1948 (2019) DOI / 10.1002/ejic.201801254
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Article Relevant pi-hole tetrel bonding interactions in ethyl 2-triazolyl-2-oxoacetate derivatives: Hirshfeld surface analysis and DFT calculations Ahmed, Muhammad Naeem; Yasin, Khawaja Ansar; Aziz, Shahid; Khan, Saba Urooge; Tahir, Muhammad Nawaz; Gil, Diego Mauricio; Frontera, Antonio CRYSTENGCOMM (2020) DOI / 10.1039/d0ce00335b
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Article Azine Steric Hindrances Switch Halogen Bonding to N-Arylation upon Interplay with sigma-Hole Donating Haloarenenitriles Baykov, Sergey V.; Geyl, Kirill K.; Ivanov, Daniil M.; Gomila, Rosa M.; Frontera, Antonio; Kukushkin, Vadim Y. CHEMISTRY-AN ASIAN JOURNAL 1861-4728 (2021) DOI / 10.1002/asia.202100282
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Article On the Importance of Nonbonding Donor-Acceptor Interactions Involving PO2 center dot Radicals: An ab Initio Study Bauza, Antonio; Frontera, Antonio CHEMPHYSCHEM 1439-4235 (2017) DOI / 10.1002/cphc.201700399
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Article Hydrogen bonding versus pi-interactions: their key competition in sildenafil solvates Barbas, Rafael; Prohens, Rafel; Font-Bardia, Merce; Bauza, Antonio; Frontera, Antonio CRYSTENGCOMM (2018) DOI / 10.1039/c8ce00567b Green accepted
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Article An inorganic-organic hybrid supramolecular framework based on the gamma-[Mo8O26](4-) cluster and cobalt complex of aspartic acid: X-ray structure and DFT study Tahmasebi, Morteza; Mirzaei, Masoud; Eshtiagh-Hosseini, Hossein; Mague, Joel T.; Bauza, Antonio; Frontera, Antonio ACTA CRYSTALLOGRAPHICA SECTION C-STRUCTURAL CHEMISTRY 0108-2701 (2019) DOI / 10.1107/s2053229619004029
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Article Anion-pi Interactions in Light-Induced Reactions: Role in the Amidation of (Hetero)aromatic Systems with Activated N-Aryloxyamides Buglioni, Laura; Mastandrea, Marco M.; Frontera, Antonio; Pericas, Miguel A. CHEMISTRY-A EUROPEAN JOURNAL 0947-6539 (2019) DOI / 10.1002/chem.201903055
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Article Diaryliodonium Tetrachloroplatinates(II): Recognition of a Trifurcated Metal-Involving mu(3)-I center dot center dot center dot(Cl,Cl,Pt) Halogen Bond Suslonov, Vitalii V.; Soldatova, Natalia S.; Ivanov, Daniil M.; Galmes, Bartomeu; Frontera, Antonio; Resnati, Giuseppe; Postnikov, Pavel S.; Kukushkin, Vadim Yu; Bokach, Nadezhda A. CRYSTAL GROWTH & DESIGN 1528-7483 (2021) DOI / 10.1021/acs.cgd.1c00654
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Article An insight into triel bonds in O,O '-diarylphosphorodithioates of thallium(I): experimental and theoretical investigations Firdoos, Tahira; Kumar, Pretam; Radha, Anu; Gomila, Rosa M.; Frontera, Antonio; Sood, Puneet; Pandey, Sushil K. NEW JOURNAL OF CHEMISTRY 1144-0546 (2021) DOI / 10.1039/d1nj04852j
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Review Tetrel bonding interactions at work: Impact on tin and lead coordination compounds Bauza, Antonio; Seth, Saikat Kumar; Frontera, Antonio COORDINATION CHEMISTRY REVIEWS 0010-8545 (2019) DOI / 10.1016/j.ccr.2019.01.003
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Article "Like-like" tetrel bonding interactions between Sn centres: a combined ab initio and CSD study Franconetti, Antonio; Frontera, Antonio DALTON TRANSACTIONS 1477-9226 (2019) DOI / 10.1039/c9dt01953g
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Article Anion Recognition by Neutral Chalcogen Bonding Receptors: Experimental and Theoretical Investigations Navarro-Garcia, Encarnacion; Galmes, Bartomeu; Velasco, Maria D.; Frontera, Antonio; Caballero, Antonio CHEMISTRY-A EUROPEAN JOURNAL 0947-6539 (2020) DOI / 10.1002/chem.201905786
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Article Supramolecular Assembly of Metal Complexes by (Aryl)I...dz2 [Pt-II] Halogen Bonds Katlenok, Eugene A.; Haukka, Matti; Levin, Oleg, V; Frontera, Antonio; Kukushkin, Vadim Yu CHEMISTRY-A EUROPEAN JOURNAL 0947-6539 (2020) DOI / 10.1002/chem.202001196 Green accepted
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Article Regium-pi Bonds Are Involved in Protein-Gold Binding de las Nieves Pina, Maria; Frontera, Antonio; Bauz, Antonio JOURNAL OF PHYSICAL CHEMISTRY LETTERS 1948-7185 (2020) DOI / 10.1021/acs.jpclett.0c02295
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Article Toward N,P-Doped pi-Extended PAHs: A One-Pot Synthesis to Diannulated 1,4,2-Diazaphospholium Triflate Salts Schoemaker, Robin; Schwedtmann, Kai; Hennersdorf, Felix; Bauza, Antonio; Frontera, Antonio; Weigand, Jan J. JOURNAL OF ORGANIC CHEMISTRY 0022-3263 (2020) DOI / 10.1021/acs.joc.0c00577
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Article Structure guided or structure guiding? Mixed carbon/hydrogen bonding in a bis-Schiff base of N-allyl isatin Hussain, Majid; Bauza, Antonio; Frontera, Antonio; Lo, Kong Mun; Naseer, Muhammad Moazzam CRYSTENGCOMM (2018) DOI / 10.1039/c7ce01697b
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Article From P-Functional Thiazol-2-thione Derivatives to Phosphaalkenes Begum, Imtiaz; Schnakenburg, Gregor; Han, Zeyu; Franconetti, Antonio; Frontera, Antonio; Gates, Derek P.; Streubel, Rainer EUROPEAN JOURNAL OF INORGANIC CHEMISTRY 1434-1948 (2019) DOI / 10.1002/ejic.201900031
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Review On the preferences of five-membered chelate rings in coordination chemistry: insights from the Cambridge Structural Database and theoretical calculations Bazargan, Maryam; Mirzaei, Masoud; Franconetti, Antonio; Frontera, Antonio DALTON TRANSACTIONS 1477-9226 (2019) DOI / 10.1039/c9dt00542k
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Article Through-Space "alpha-Effect" between the Bridging Oxygen Atoms in Diepoxybenzo[de]isothiochromene Derivatives Kvyatkovskaya, Elizaveta A.; Nikitina, Eugeniya V.; Khrustalev, Victor N.; Galmes, Bartomeu; Zubkov, Fedor I.; Frontera, Antonio EUROPEAN JOURNAL OF ORGANIC CHEMISTRY 1434-193X (2020) DOI / 10.1002/ejoc.201901169
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Article Supramolecular architectures of Mn(NCS)(2) complexes with N '-(1-(pyridin-4-yl)ethylidene)picolinohydrazide and N '-(phenyl(pyridin-4-yl)methylene)isonicotinohydrazide Mahmoudi, Ghodrat; Kubicki, Maciej; Choquesillo-Lazarte, Duane; Miroslaw, Barbara; Alexandrov, Eugeny, V; Zolotarev, Pavel N.; Frontera, Antonio; Safin, Damir A. POLYHEDRON 0277-5387 (2020) DOI / 10.1016/j.poly.2020.114776
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Article Novel 'main-part' isostructuralism in metal complexes with 1-methylimidazole: crystal structures, energy calculations and magnetic properties Perez, Hiram; Di Santo, Alejandro; Piro, Oscar E.; Echeverria, Gustavo A.; Gonzalez, Marlene; Ben Altabef, Aida; Gomila, Rosa M.; Frontera, Antonio; Gil, Diego M. DALTON TRANSACTIONS 1477-9226 (2021) DOI / 10.1039/d1dt03159g
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Article Cu(II)-N-6-Alkyladenine Complexes: Synthesis, X-ray Characterization and Magnetic Properties Soledad Martinez, Maria; Bauza, Antonio; Caubet, Amparo; Garcia-Raso, Angel; Terron, Angel; Fiol, Juan J.; Molins, Elies; Barcelo-Oliver, Miquel; Frontera, Antonio MAGNETOCHEMISTRY (2018) DOI / 10.3390/magnetochemistry4020024 Gold other
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Article Diaryliodonium as a double sigma-hole donor: the dichotomy of thiocyanate halogen bonding provides divergent solid state arylation by diaryliodonium cations Soldatova, Natalia S.; Postnikov, Pavel S.; Suslonov, VitaIli V.; Kissler, Troyana Yu; Ivanov, Daniil M.; Yusubov, Mekhman S.; Galmes, Bartomeu; Frontera, Antonio; Kukushkin, Vadim Yu ORGANIC CHEMISTRY FRONTIERS 2052-4129 (2020) DOI / 10.1039/d0qo00678e
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Article Recurrent motifs in pharmaceutical cocrystals involving glycolic acid: X-ray characterization, Hirshfeld surface analysis and DFT calculations Alvarez-Lorenzo, C.; Castineiras, A.; Frontera, A.; Garcia-Santos, I; Gonzalez-Perez, J. M.; Niclos-Gutierrez, J.; Rodriguez-Gonzalez, I; Vilchez-Rodriguez, E.; Zareba, J. K. CRYSTENGCOMM (2020) DOI / 10.1039/d0ce01064b
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Article Halogen Bonds in Protein Nucleic Acid Recognition Frontera, Antonio; Bauza, Antonio JOURNAL OF CHEMICAL THEORY AND COMPUTATION 1549-9618 (2020) DOI / 10.1021/acs.jctc.0c00431
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Article Synthesis of Ni(ii)-Mn(ii) complexes using a new mononuclear Ni(ii) complex of an unsymmetrical N2O3 donor ligand: structures, magnetic properties and catalytic oxidase activity Maity, Souvik; Mahapatra, Prithwish; Ghosh, Tanmoy Kumar; Gomila, Rosa M.; Frontera, Antonio; Ghosh, Ashutosh DALTON TRANSACTIONS 1477-9226 (2021) DOI / 10.1039/d0dt04337k
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Review Spodium bonding in five coordinated Zn(ii): a new player in crystal engineering? Gomila, Rosa M.; Bauza, Antonio; Mooibroek, Tiddo J.; Frontera, Antonio CRYSTENGCOMM (2021) DOI / 10.1039/d1ce00221j
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Article Screening polymorphism in a Ni(II) metal-organic framework: experimental observations, Hirshfeld surface analyses and DFT studies Seth, Saikat Kumar; Bauza, Antonio; Frontera, Antonio CRYSTENGCOMM (2018) DOI / 10.1039/c7ce01991b
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Article Supramolecular network of a framework material supported by the anion-pi linkage of Keggin-type heteropolyoxotungstates: experimental and theoretical insights Samaniyan, Maryam; Mirzaei, Masoud; Gomila, Rosa M.; Eshtiagh-Hosseini, Hossein; Lotfian, Nahid; Mague, Joel T.; Pour, Ali Nakhaei; Frontera, Antonio DALTON TRANSACTIONS 1477-9226 (2021) DOI / 10.1039/d0dt03891a
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Article Selenium chalcogen bonds are involved in protein-carbohydrate recognition: a combined PDB and theoretical study Fernandez Riveras, Jose A.; Frontera, Antonio; Bauza, Antonio PHYSICAL CHEMISTRY CHEMICAL PHYSICS 1463-9076 (2021) DOI / 10.1039/d1cp01929e
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Article A convenient access to fluorophosphonium triflate salts by electrophilic fluorination and anion exchange Guo, Chun-xiang; Yogendra, Sivathmeehan; Gomila, Rosa M.; Frontera, Antonio; Hennersdorf, Felix; Steup, Johannes; Schwedtmann, Kai; Weigand, Jan J. INORGANIC CHEMISTRY FRONTIERS 2052-1553 (2021) DOI / 10.1039/d1qi00322d
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Article Solid-state supramolecular architectures of a series of Hg(ii) halide coordination compounds based on hydroxyl-substituted Schiff base ligands Hajiashrafi, Taraneh; Salehi, Shiva; Kubicki, Maciej; Bauza, Antonio; Frontera, Antonio; Flanagan, Keith J.; Senge, Mathias O. CRYSTENGCOMM (2019) DOI / 10.1039/c9ce01078e
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Article The Effect of Guest Metal Ions on the Reduction Potentials of Uranium(VI) Complexes: Experimental and Theoretical Investigations Ghosh, Tanmoy Kumar; Mahapatra, Prithwish; Drew, Michael G. B.; Franconetti, Antonio; Frontera, Antonio; Ghosh, Ashutosh CHEMISTRY-A EUROPEAN JOURNAL 0947-6539 (2020) DOI / 10.1002/chem.201904253
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Editorial Material Anion Recognition by Neutral Chalcogen Bonding Receptors: Experimental and Theoretical Investigation Navarro-Garcia, Encarnacion; Galmes, Bartomeu; Velasco, Maria D.; Frontera, Antonio; Caballero, Antonio CHEMISTRY-A EUROPEAN JOURNAL 0947-6539 (2020) DOI / 10.1002/chem.202000493 Bronze
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Article DFT Analysis of Uncommon pi center dot center dot center dot H-Bond Array Interaction in a New Pterostilbene/Theophylline Cocrystal Bofill, Lidia; Prohens, Rafel; Barbas, Rafael; Frontera, Antonio CRYSTAL GROWTH & DESIGN 1528-7483 (2020) DOI / 10.1021/acs.cgd.0c00845
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Article Exploration of photocatalytic activity of an end-on azide bridged one-dimensional cadmium(II) Schiff base complex for the degradation of organic dye in visible light Roy, Sumit; Harms, Klaus; Bauza, Antonio; Frontera, Antonio; Chattopadhyay, Shouvik POLYHEDRON 0277-5387 (2017) DOI / 10.1016/j.poly.2016.09.018
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Article EPR interpretation, magnetism and biological study of a Cu(II) dinuclear complex assisted by a schiff base precursor Das, Kuheli; Patra, Chiranjit; Sen, Chandana; Datta, Amitabha; Massera, Chiara; Garribba, Eugenio; El Fallah, Mohamed Salah; Beyene, Belete B.; Hung, Chen-Hsiung; Sinha, Chittaranjan; Askun, Tulin; Celikboyun, Pinar; Escudero, Daniel; Frontera, Antonio JOURNAL OF BIOLOGICAL INORGANIC CHEMISTRY 0949-8257 (2017) DOI / 10.1007/s00775-016-1428-x
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Article Selective and Reversible Fluoride Complexation from Water by a Cyclic Tri(phosphonio)methanide Dication Yogendra, Sivathmeehan; Hennersdorf, Felix; Bauza, Antonio; Frontera, Antonio; Fischer, Roland; Weigand, Jan J. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION 1433-7851 (2017) DOI / 10.1002/anie.201701570
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Article A Cd(II)-based MOF as a photosensitive Schottky diode: experimental and theoretical studies Halder, Shibashis; Dey, Arka; Bhattacharjee, Aradhita; Ortega-Castro, Joaquin; Frontera, Antonio; Ray, Partha Pratim; Roy, Partha DALTON TRANSACTIONS 1477-9226 (2017) DOI / 10.1039/c7dt02184d
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Article Zinc(II) complexes with uncommon aminal and hemiaminal ether derivatives: synthesis, structure, phosphatase activity and theoretical rationalization of ligand and complex formation Purkait, Suranjana; Chakraborty, Prateeti; Frontera, Antonio; Bauza, Antonio; Zangrando, Ennio; Das, Debasis NEW JOURNAL OF CHEMISTRY 1144-0546 (2018) DOI / 10.1039/c8nj01853g
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Article Energetically favorable anti-electrostatic hydrogen bonded cationic clusters in Ni(II) 3,5-dimethylpyrazole complexes: Anticancer evaluation and theoretical studies Gogoi, Anshuman; Dutta, Debajit; Verma, Akalesh K.; Nath, Hiren; Frontera, Antonio; Guha, Ankur K.; Bhattacharyya, Manjit K. POLYHEDRON 0277-5387 (2019) DOI / 10.1016/j.poly.2019.04.043
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Article Indirect influence of alkyl substituent on sigma-hole interactions: The case study of antimony(III) diphenyldithiophosphates with covalent Sb-S and non-covalent Sb center dot center dot center dot S pnictogen bonds Radha, Anu; Kumar, Sandeep; Sharma, Deepika; Jassal, Amanpreet K.; Zareba, Jan K.; Franconetti, Antonio; Frontera, Antonio; Sood, Puneet; Pandey, Sushil K. POLYHEDRON 0277-5387 (2019) DOI / 10.1016/j.poly.2019.114126
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Article Energetically significant unconventional O-H center dot center dot center dot pi contacts involving discrete guest (H2O)(8) clusters in a fumarato bridged polymeric supramolecular host of Ni(II) phenanthroline: Antiproliferative evaluation and theoretical Nath, Hiren; Sharma, Pranay; Frontera, Antonio; Verma, Akalesh K.; Das, Amal; Barcelo-Oliver, Miquel; Bhattacharyya, Manjit K. POLYHEDRON 0277-5387 (2020) DOI / 10.1016/j.poly.2019.114266
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Article Supramolecular assemblies involving biologically relevant antiparallel pi-stacking and unconventional solvent driven structural topology in maleato and fumarato bridged Zn(II) coordination polymers: antiproliferative evaluation and theoretical studies Das, Amal; Sharma, Pranay; Frontera, Antonio; Barcelo-Oliver, Miquel; Verma, Akalesh K.; Ahmed, Ruksana Sultana; Hussain, Sahid; Bhattacharyya, Manjit K. NEW JOURNAL OF CHEMISTRY 1144-0546 (2021) DOI / 10.1039/d1nj00619c
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Article Phenanthroline-based Ni(II) coordination compounds involving unconventional discrete fumarate-water-nitrate clusters and energetically significant cooperative ternary pi-stacked assemblies: Antiproliferative evaluation and theoretical studies Nath, Hiren; Sharma, Pranay; Frontera, Antonio; Barcelo-Oliver, Miquel; Verma, Akalesh K.; Das, Jumi; Bhattacharyya, Manjit K. JOURNAL OF MOLECULAR STRUCTURE 0022-2860 (2021) DOI / 10.1016/j.molstruc.2021.131424
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Article Solvothermal self assembly of three lanthanide(III)-succinates: Crystal structure, topological analysis and DFT calculations on water channel Ashashi, Nargis Akhter; Kumar, Manesh; ul Nisa, Zaib; Frontera, Antonio; Sahoo, Subash Chandra; Sheikh, Haq Nawaz JOURNAL OF MOLECULAR STRUCTURE 0022-2860 (2021) DOI / 10.1016/j.molstruc.2021.131094
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Article Large interaction energy for the homodimer and the heterodimer extracted from the supramolecular chain of a bent trinuclear zinc(ii) complex with a reduced Schiff base ligand Karmakar, Mainak; Gomila, Rosa M.; Frontera, Antonio; Chattopadhyay, Shouvik NEW JOURNAL OF CHEMISTRY (2021) DOI / 10.1039/d1nj03984a
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Article Spodium bonds and metal-halogen center dot center dot center dot halogen-metal interactions in propagation of monomeric units to dimeric or polymeric architectures Alizadeh, Vali; Mahmoudi, Ghodrat; Vinokurova, Marina A.; Pokazeev, Kuzma M.; Alekseeva, Kseniia A.; Miroslaw, Barbara; Khandar, Ali Akbar; Frontera, Antonio; Safin, Damir A. JOURNAL OF MOLECULAR STRUCTURE (2021) DOI / 10.1016/j.molstruc.2021.132144
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Article Surface-grafted lanthanoid complexes of the tungstosilicate polyanion [SiW12O40](4-) : a synthetic, structural and computational investigation Derakhshanrad, Shadi; Mirzaei, Masoud; Najafi, Atefeh; Ritchie, Chris; Bauza, Antonio; Frontera, Antonio; Mague, Joel T. ACTA CRYSTALLOGRAPHICA SECTION C-STRUCTURAL CHEMISTRY 0108-2701 (2018) DOI / 10.1107/s2053229618009580
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Review sigma/pi-Hole noble gas bonding interactions: Insights from theory and experiment Bauza, Antonio; Frontera, Antonio COORDINATION CHEMISTRY REVIEWS 0010-8545 (2020) DOI / 10.1016/j.ccr.2019.213112
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Article A late appearing polymorph of nutraceutical pterostilbene Bofill, Lidia; de Sande, Dafne; Barbas, Rafael; Frontera, Antonio; Prohens, Rafel CRYSTENGCOMM (2020) DOI / 10.1039/d0ce00837k
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Article Unconventional formation of a 1D-chain of H-bonded water molecules in bipyridine-based supramolecular hexameric hosts of isostructural coordination compounds of Co(II) and Zn(II): Antiproliferative evaluation and theoretical studies Chetry, Sanjib; Sharma, Pranay; Frontera, Antonio; Dutta, Debajit; Verma, Akalesh K.; Bhattacharyya, Manjit K. POLYHEDRON 0277-5387 (2020) DOI / 10.1016/j.poly.2020.114809
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Article A first exploration of isostructurality in transition metal nitroprussides: X-ray analysis, magnetic properties and DFT calculations Perez, Hiram; Di Santo, Alejandro; Piro, Oscar E.; Echeverria, Gustavo A.; Cano, A.; Gonzalez, M.; Rodriguez-Hernandez, J.; Ben Altabef, A.; Frontera, Antonio; Gil, Diego M. CRYSTENGCOMM (2021) DOI / 10.1039/d0ce01596b
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Article 5,5 '-Dibenzoimidazole as building block for a new 3D Co(II) coordination polymer: A combined EPR and DFT study using UB3LYP model Datta, Amitabha; Massera, Chiara; Garribba, Eugenio; Frontera, Antonio POLYHEDRON 0277-5387 (2019) DOI / 10.1016/j.poly.2019.07.029
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Article Molecular and supramolecular recognition patterns in ternary copper(II) or zinc(II) complexes with selected rigid-planar chelators and a synthetic adenine-nucleoside Ruiz-Gonzalez, Noelia; Eugenia Garcia-Rubina, M.; Dominguez-Martin, Alicia; Choquesillo-Lazarte, Duane; Franconetti, Antonio; Frontera, Antonio; Castineiras, Alfonso; Gonzalez-Perez, Josefa M.; Niclos-Gutierrez, Juan JOURNAL OF INORGANIC BIOCHEMISTRY 0162-0134 (2020) DOI / 10.1016/j.jinorgbio.2019.110920
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Article Exploitation of the electron deficient outer O-4 compartment of a compartmental Schiff base to act as H-bond acceptors in forming a self-assembled dimer of a manganese(III) complex: A joint experimental and theoretical venture Bhaumik, Prasanta Kumar; Frontera, Antonio; Chattopadhyay, Shouvik POLYHEDRON 0277-5387 (2020) DOI / 10.1016/j.poly.2020.114711
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Article Biologically relevant unusual cooperative assemblies and fascinating infinite crown-like supramolecular nitrate-water hosts involving guest complex cations in bipyridine and phenanthroline-based Cu(II) coordination compounds: antiproliferative evaluation a Sharma, Pranay; Nath, Hiren; Frontera, Antonio; Barcelo-Oliver, Miquel; Verma, Akalesh K.; Hussain, Sahid; Bhattacharyya, Manjit K. NEW JOURNAL OF CHEMISTRY 1144-0546 (2021) DOI / 10.1039/d1nj01004b
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Article Tri- and pentanuclear CuII?CdII complexes of N2O2 donor ligands with the variation of carboxylate coligands: Structural elucidation and theoretical study Ganguly, Sayantan; Drew, Michael G. B.; Gomila, Rosa M.; Frontera, Antonio; Ghosh, Ashutosh INORGANICA CHIMICA ACTA 0020-1693 (2021) DOI / 10.1016/j.ica.2021.120351
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Article Weak Interactions in Cocrystals of Isoniazid with Glycolic and Mandelic Acids Alvarez-Vidaurre, Raquel; Castineiras, Alfonso; Frontera, Antonio; Garcia-Santos, Isabel; Gil, Diego M.; Gonzalez-Perez, Josefa M.; Niclos-Gutierrez, Juan; Torres-Iglesias, Rocio CRYSTALS (2021) DOI / 10.3390/cryst11040328 Gold DOAJ, Green published
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Article Uracil Derivatives for Halogen-Bonded Cocrystals Benito, Monica; Rosello, Yannick; Barcelo-Oliver, Miquel; Frontera, Antonio; Molins, Elies INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES 1661-6596 (2021) DOI / 10.3390/ijms221910663 Green published, Gold
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Article Charge assisted hydrogen bonded assemblies and unconventional O center dot center dot center dot O dichalcogen bonding interactions in pyrazole-based isostructural Ni(II) and Mn(II) compounds involving anthraquinone disulfonate: Antiproliferative evaluatio Sarma, Pinku; Sharma, Pranay; Gomila, Rosa M.; Frontera, Antonio; Barcelo-Oliver, Miquel; Verma, Akalesh K.; Baruwa, Bandita; Bhattacharyya, Manjit K. JOURNAL OF MOLECULAR STRUCTURE (2021) DOI / 10.1016/j.molstruc.2021.131883
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Article Observation of pi-hole interactions in the solid state structures of three new copper(II) complexes with a tetradentate N-4 donor Schiff base: Exploration of their cytotoxicity against MDA-MB 468 cells Khan, Samim; Al Masum, Abdulla; Islam, Md. Maidul; Drew, Michael G. B.; Bauza, Antonio; Frontera, Antonio; Chattopadhyay, Shouvik POLYHEDRON 0277-5387 (2017) DOI / 10.1016/j.poly.2016.11.012
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Article Hydrogen Bond versus Halogen Bond in HXOn (X = F, Cl, Br, and I) Complexes with Lewis Bases Quinonero, David; Frontera, Antonio INORGANICS (2019) DOI / 10.3390/inorganics7010009 Gold, Green submitted
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Article Werner type clathrates involving guest benzoic acid and benzoate in discrete Mn(II) hosts: Experimental and theoretical studies Saha, Utpal; Dutta, Debajit; Bauza, Antonio; Frontera, Antonio; Sarma, Bipul; Bhattacharyya, Manjit K. POLYHEDRON 0277-5387 (2019) DOI / 10.1016/j.poly.2018.11.068
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Article pi-Hole spodium bonding in tri-coordinated Hg(ii) complexes Gomila, Rosa M.; Bauza, Antonio; Mooibroek, Tiddo J.; Frontera, Antonio DALTON TRANSACTIONS 1477-9226 (2021) DOI / 10.1039/d1dt01235e
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Article A Ni-based MOF for selective detection and removal of Hg2+ in aqueous medium: a facile strategy Halder, Shibashis; Mondal, John; Ortega-Castro, Joaqu-N; Frontera, Antonio; Roy, Partha DALTON TRANSACTIONS 1477-9226 (2017) DOI / 10.1039/c6dt04722j
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Article Phosphatase Mimicking Activity of Two Zinc(II) Schiff Base Complexes with Zn(2)O(2)Cores: NBO Analysis and MEP Calculation to Estimate Non-Covalent Interactions Basak, Tanmoy; Bhattacharyya, Anik; Das, Mithun; Harms, Klaus; Bauza, Antonio; Frontera, Antonio; Chattopadhyay, Shouvik CHEMISTRYSELECT 2365-6549 (2017) DOI / 10.1002/slct.201701246
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Article Suitable Interplay between Various Conventional and Unconventional Non-Covalent Interactions in Forming Self-Assembled Supramolecules of Two Ni(II)/Zn(II) Schiff Base Complexes Roy, Sourav; Drew, Michael. G. B.; Frontera, Antonio; Chattopadhyay, Shouvik CHEMISTRYSELECT 2365-6549 (2017) DOI / 10.1002/slct.201700853
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Article Polymorphism in secondary squaramides: on the importance of pi-interactions involving the four membered ring Prohens, Rafel; Portell, Anna; Vallcorba, Oriol; Font-Bardia, Merce; Bauza, Antonio; Frontera, Antonio CRYSTENGCOMM (2018) DOI / 10.1039/c7ce01945a Green accepted
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Article Bonded anion-anion complex trapped in a squaramido-based receptor Prohens, Rafel; Portell, Anna; Font-Bardia, Merce; Bauza, Antonio; Frontera, Antonio CHEMICAL COMMUNICATIONS 1359-7345 (2018) DOI / 10.1039/c7cc09241e Green accepted
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Article Remote Control of Anion-pi Catalysis on Fullerene-Centered Catalytic Triads Lopez-Andarias, Javier; Bauza, Antonio; Sakai, Naomi; Frontera, Antonio; Matile, Stefan ANGEWANDTE CHEMIE-INTERNATIONAL EDITION 1433-7851 (2018) DOI / 10.1002/anie.201804092 Green published, Hybrid
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Article Antiproliferative evaluation and supramolecular association in Mn(II) and Zn(II) bipyridine complexes: Combined experimental and theoretical studies Bhattacharyya, Manjit K.; Gogoi, Anshuman; Chetry, Sanjib; Dutta, Debajit; Verma, Akalesh K.; Sarma, Bipul; Franconetti, Antonio; Frontera, Antonio JOURNAL OF INORGANIC BIOCHEMISTRY 0162-0134 (2019) DOI / 10.1016/j.jinorgbio.2019.110803
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Article Engineering Crystals Using sp(3)-C Centred Tetrel Bonding Interactions Roeleveld, Julius J.; Deprez, Siebe J. Lekanne; Verhoofstad, Abraham; Frontera, Antonio; van der Vlugt, Jarl Ivar; Mooibroek, Tiddo Jonathan CHEMISTRY-A EUROPEAN JOURNAL 0947-6539 (2020) DOI / 10.1002/chem.202002613 Gold other, Green published
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Article A theoretical insight into the formation of chalcogen bonding (ChB) interactions involving coordinated DMSO molecules as sigma-hole donors and benzoate groups as sigma-hole acceptors in a dinuclear copper(ii) complex Thakur, Snehasish; Gomila, Rosa M.; Frontera, Antonio; Chattopadhyay, Shouvik CRYSTENGCOMM (2021) DOI / 10.1039/d1ce00624j
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Article Biological halogen bonds in protein-ligand complexes: a combined QTAIM and NCIPlot study in four representative cases Frontera, Antonio; Bauza, Antonio ORGANIC & BIOMOLECULAR CHEMISTRY 1477-0520 (2021) DOI / 10.1039/d1ob01212f
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Article Supramolecular, spectroscopic and computational analysis of weak interactions in some thiosemicarbazones derived from 5-acetylbarbituric acid Castineiras, Alfonso; Fernandez-Hermida, Nuria; Garcia-Santos, Isabel; Gomez-Rodriguez, Lourdes; Gil, Diego M.; Frontera, Antonio JOURNAL OF MOLECULAR STRUCTURE 0022-2860 (2021) DOI / 10.1016/j.molstruc.2021.131031 Hybrid
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Article Ligand-Flexibility Controlled and Solvent-Induced Nuclearity Conversion in Cu-II-Based Catecholase Models: A Deep Insight Through Combined Experimental and Theoretical Investigations Dasgupta, Sanchari; Majumder, Ishani; Chakraborty, Prateeti; Zangrando, Ennio; Bauza, Antonio; Frontera, Antonio; Das, Debasis EUROPEAN JOURNAL OF INORGANIC CHEMISTRY 1434-1948 (2017) DOI / 10.1002/ejic.201600985
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Article The Mouse in a Trap: Observation of a C(sp(3)) -F center dot center dot center dot F-C(sp(3)) Interaction in a Discrete CFC Pair by the Crystal Sponge Method Sanna, Elena; Bauza, Antonio; Escudero-Adan, Eduardo C.; Rotger, Carmen; Frontera, Antonio; Costa, Antonio CRYSTAL GROWTH & DESIGN 1528-7483 (2017) DOI / 10.1021/acs.cgd.7b00736
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Article Supramolecular coordination polymers of La(III), Ce(III), Sm(III), Gd(III) and Eu(III) decorated with rigid 5-hydroxy-1,3-benzenedicarboxylate and flexible hexane-1,6-dicarboxylate linkers: Syntheses, structures, DFT study, luminescence and magnetic proper Kariem, Mukaddus; Yawer, Mohd; Kumar, Manesh; Sheikh, Haq Nawaz; Sood, Puneet; Frontera, Antonio; Ortega-Castro, Joaquin POLYHEDRON 0277-5387 (2017) DOI / 10.1016/j.poly.2017.06.014
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Article Substituent Effects in Multivalent Halogen Bonding Complexes: A Combined Theoretical and Crystallographic Study Bauza, Antonio; Quinonero, David; Frontera, Antonio MOLECULES (2018) DOI / 10.3390/molecules23010018 Gold DOAJ, Green published
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Article Estimating the energy of noncovalent interactions in a dioxovanadium(V) Schiff base complex: Exploration of its phenoxazinone synthase like activity Thakur, Snehasish; Sarkar, Nandita; Drew, Michael G. B.; Bauza, Antonio; Frontera, Antonio; Chattopadhyay, Shouvik POLYHEDRON 0277-5387 (2018) DOI / 10.1016/j.poly.2017.11.053
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Article Recurrent supramolecular motifs in discrete complexes and coordination polymers based on mercury halides: prevalence of chelate ring stacking and substituent effects Mahmoudi, Ghodrat; Zareba, Jan K.; Bauza, Antonio; Kubicki, Maciej; Bartyzel, Agata; Keramidas, Anastasios D.; Butusov, Leonid; Miroslaw, Barbara; Frontera, Antonio CRYSTENGCOMM (2018) DOI / 10.1039/c7ce02166f Hybrid
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Article copper(II) polyamine chelates as efficient receptors for acyclovir: syntheses, crystal structures and dft study Perez-Toro, Inmaculada; Dominguez-Martin, Alicia; Choquesillo-Lazarte, Duane; Eugenia Garcia-Rubino, Maria; Gonzalez-Perez, Josefa M.; Castineiras, Alfonso; Bauza, Antonio; Frontera, Antonio; Niclos-Gutierrez, Juan POLYHEDRON 0277-5387 (2018) DOI / 10.1016/j.poly.2018.02.011
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Article A versatile chemosensor for the detection of Al3+ and picric acid (PA) in aqueous solution Naskar, Barnali; Bauza, Antonio; Frontera, Antonio; Maiti, Dilip K.; Das Mukhopadhyay, Chitrangada; Goswami, Sanchita DALTON TRANSACTIONS 1477-9226 (2018) DOI / 10.1039/c8dt02289e
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Article Synthesis, characterization and DFT study on two copper(II) complexes with a naphthalene-based Schiff base: Examples of stronger chelate-chelate interactions than those reported for classical pi-pi complexes Khan, Samim; Giri, Pritam; Bauza, Antonio; Harms, Klaus; Frontera, Antonio; Chattopadhyay, Shouvik POLYHEDRON 0277-5387 (2019) DOI / 10.1016/j.poly.2018.09.074
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Article Supramolecular association in Cu(II) coordination complexes involving energetically significant NO center dot center dot center dot NO pi-hole interaction and cooperative pi-stacked ternary assembly: Experimental and theoretical studies Saha, Utpal; Dutta, Debajit; Nath, Hiren; Franconetti, Antonio; Frontera, Antonio; Bhattacharyya, Manjit K. INORGANICA CHIMICA ACTA 0020-1693 (2019) DOI / 10.1016/j.ica.2019.01.015
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Article Formation of an imidazoliumyl-substituted [(L-C)(4)P-4](4+) tetracation and transition metal mediated fragmentation and insertion reaction (L-C = NHC) Schwedtmann, Kai; Haberstroh, Jan; Roediger, Sven; Bauza, Antonio; Frontera, Antonio; Hennersdorf, Felix; Weigand, Jan J. CHEMICAL SCIENCE 2041-6520 (2019) DOI / 10.1039/c9sc01701a Gold DOAJ, Green published
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Article Self-assembly of amphiphilic aryl-squaramides in water driven by dipolar pi-pi interactions Bujosa, Sergi; Castellanos, Eduardo; Frontera, Antonio; Rotger, Carmen; Costa, Antonio; Soberats, Bartolome ORGANIC & BIOMOLECULAR CHEMISTRY 1477-0520 (2020) DOI / 10.1039/c9ob02085c
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Article Differentiating intramolecular spodium bonds from coordination bonds in two polynuclear zinc(ii) Schiff base complexes Basak, Tanmoy; Gomila, Rosa M.; Frontera, Antonio; Chattopadhyay, Shouvik CRYSTENGCOMM (2021) DOI / 10.1039/d1ce00214g
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Article Benzoato bridged dinuclear Mn(II) and Cu(II) compounds involving guest chlorobenzoates and dimeric paddle wheel supramolecular assemblies: Antiproliferative evaluation and theoretical studies Sharma, Pranay; Dutta, Debasish; Gomila, Rosa M.; Frontera, Antonio; Barcelo-Oliver, Miquel; Verma, Akalesh K.; Bhattacharyya, Manjit K. POLYHEDRON 0277-5387 (2021) DOI / 10.1016/j.poly.2021.115409
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Article Polymorphism in the 1/1 Pterostilbene/Picolinic Acid Cocrystal Barbas, Rafael; Font-Bardia, Merce; Frontera, Antonio; Prohens, Rafel CRYSTAL GROWTH & DESIGN (2021) DOI / 10.1021/acs.cgd.1c01146
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Article Metalloid Chalcogen-pnictogen sigma-hole bonding competition in stibanyl telluranes Gomila, Rosa M.; Frontera, Antonio JOURNAL OF ORGANOMETALLIC CHEMISTRY (2021) DOI / 10.1016/j.jorganchem.2021.122092
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Article Accidental Orthogonality Induced Weak Magnetic Coupling in a Dinuclear Copper(II) Complex: Exploration of Unconventional C-H center dot center dot center dot pi(SCN) Interactions and Catechol Oxidase Activity Roy, Sourav; Bhattacharyya, Anik; Herrero, Santiago; Gonzalez-Prieto, Rodrigo; Frontera, Antonio; Chattopadhyay, Shouvik CHEMISTRYSELECT 2365-6549 (2017) DOI / 10.1002/slct.201701016
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Article Anion-pi Catalysis on Fullerenes Lopez-Andarias, Javier; Frontera, Antonio; Matile, Stefan JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 0002-7863 (2017) DOI / 10.1021/jacs.7b08113 Green submitted, Hybrid
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Article Valence-Tautomerism-Driven Aromatic Nucleophilic Substitution in Cobalt-Bound Tetrabromocatecholate Ligands - Influence of Positive Charge at the Ligand Backbone on Phenoxazinone Synthase Activity Panja, Anangamohan; Frontera, Antonio EUROPEAN JOURNAL OF INORGANIC CHEMISTRY 1434-1948 (2018) DOI / 10.1002/ejic.201701176
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Article Chalcogen 'like-like' Interactions Involving Trisulphide and Triselenide Compounds: A Combined CSD and Ab Initio Study Bauza, Antonio; Frontera, Antonio MOLECULES (2018) DOI / 10.3390/molecules23030699 Gold DOAJ, Green published
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Article Synthesis of Multinuclear Zn(II) Complexes Involving 8-Aminoquinoline- Based Schiff-Base Ligand: Structural Diversity, DNA Binding Studies and Theoretical Calculations Ghorai, Pravat; Brandao, Paula; Bauza, Antonio; Frontera, Antonio; Saha, Amrita CHEMISTRYSELECT 2365-6549 (2018) DOI / 10.1002/slct.201801273
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Article Sn Tetrel Bonds in the Activation of Peroxisome Proliferator-Activated Receptors (PPARs) by Organotin Molecules Frontera, Antonio; Bauza, Antonio CHEMISTRY-A EUROPEAN JOURNAL 0947-6539 (2018) DOI / 10.1002/chem.201804676
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Article Intramolecular pi-hole interactions with nitro aromatics Franconetti, Antonio; Frontera, Antonio; Mooibroek, Tiddo J. CRYSTENGCOMM (2019) DOI / 10.1039/c9ce01015g
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Article A combined experimental and theoretical study on an ionic cobalt(III/II) complex with a Schiff base ligand Ghosh, Kousik; Dutta, Tamal; Drew, Michael G. B.; Frontera, Antonio; Chattopadhyay, Shouvik POLYHEDRON 0277-5387 (2020) DOI / 10.1016/j.poly.2020.114432
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Article Role of Imidazole Co-Ligand in the Supramolecular Network of a Co(II) Complex with Sulfadiazine: Crystal Structure, Hirshfeld Surface Analysis and Energetic Calculations Gil, Diego M.; Perez, Hiram; Echeverria, Gustavo A.; Piro, Oscar E.; Frontera, Antonio CHEMISTRYSELECT 2365-6549 (2020) DOI / 10.1002/slct.202001567
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Article Molecular 1,1 '-bifunctional mixed-valence P-P compounds, enabled through metal complexation Schmer, Alexander; Bauza, Antonio; Schnakenburg, Gregor; Frontera, Antonio; Streubel, Rainer DALTON TRANSACTIONS 1477-9226 (2021) DOI / 10.1039/d0dt04070c
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Article Heteronuclear cobalt(III)/sodium complexes with salen type compartmental Schiff base ligands: methylene spacer regulated variation in nuclearity Ghosh, Kousik; Harms, Klaus; Bauza, Antonio; Frontera, Antonio; Chattopadhyay, Shouvik DALTON TRANSACTIONS 1477-9226 (2018) DOI / 10.1039/c7dt03929h
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Article Synthesis, Substitution, and Oxidation of Imidazole-2-thione Based Tricyclic 1,4-Dihydro-1,4-diphosphinines Koner, Abhishek; Sauerbrey, Susanne; Schnakenburg, Gregor; Bauza, Antonio; Frontera, Antonio; Streubel, Rainer EUROPEAN JOURNAL OF INORGANIC CHEMISTRY 1434-1948 (2018) DOI / 10.1002/ejic.201701338
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Article Methylene spacer regulated variation in conformation of tetradentate N2O2 donor Schiff bases trapped in manganese(III) complexes Sarkar, Nandita; Drew, Michael G. B.; Harms, Klaus; Bauza, Antonio; Frontera, Antonio; Chattopadhyay, Shouvik CRYSTENGCOMM (2018) DOI / 10.1039/c7ce02019h
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Article Importance of pi-Interactions Involving Chelate Rings in Addition to the Tetrel Bonds in Crystal Engineering: A Combined Experimental and Theoretical Study on a Series of Hemi- and Holodirected Nickel(II)/Lead(II) Complexes Mirdya, Saikat; Roy, Sourav; Chatterjee, Sudipta; Bauza, Antonio; Frontera, Antonio; Chattopadhyay, Shouvik CRYSTAL GROWTH & DESIGN 1528-7483 (2019) DOI / 10.1021/acs.cgd.9b00881
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Article HalogenMIDLINE HORIZONTAL ELLIPSIShalogen interactions in decahalo-closo-carboranes: CSD analysis and theoretical study de las Nieves Pina, Maria; Bauza, Antonio; Frontera, Antonio PHYSICAL CHEMISTRY CHEMICAL PHYSICS 1463-9076 (2020) DOI / 10.1039/d0cp00114g
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Article Selective Metal-Ligand Bond-Breaking Driven by Weak Intermolecular Interactions: From Metamagnetic Mn(III)-Monomer to Hexacyanoferrate(II)-Bridged Metamagnetic Mn2Fe Trimer Goswami, Somen; Singha, Soumen; Saha, Indrajit; Chatterjee, Abhishikta; Dey, Subrata K.; Gomez Garcia, Carlos J.; Frontera, Antonio; Kumar, Sanjay; Saha, Rajat INORGANIC CHEMISTRY 0020-1669 (2020) DOI / 10.1021/acs.inorgchem.0c00909
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Article Noble metals in polyoxometalates Tahmasebi, Morteza; Mirzaei, Masoud; Frontera, Antonio INORGANICA CHIMICA ACTA 0020-1693 (2021) DOI / 10.1016/j.ica.2021.120410
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Article Unconventional pi-hole and Semi-coordination regium bonding interactions directed supramolecular assemblies in pyridinedicarboxylato bridged polymeric Cu(II) Compounds: Antiproliferative evaluation and theoretical studies Sarma, Pinku; Sharma, Pranay; Frontera, Antonio; Barcelo-Oliver, Miquel; Verma, Akalesh K.; Barthakur, Trinayan; Bhattacharyya, Manjit K. INORGANICA CHIMICA ACTA 0020-1693 (2021) DOI / 10.1016/j.ica.2021.120461
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Article 1-Ethyluracil, a New Scaffold for Preparing Multicomponent Forms: Synthesis, Characterization, and Computational Studies Rosello, Yannick; Benito, Monica; Barcelo-Oliver, Miquel; Frontera, Antonio; Molins, Elies CRYSTAL GROWTH & DESIGN 1528-7483 (2021) DOI / 10.1021/acs.cgd.1c00175 Green submitted, Hybrid
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Article The development of a promising photosensitive Schottky barrier diode using a novel Cd(II) based coordination polymer Ghorai, Pravat; Dey, Arka; Brandao, Paula; Ortega-Castro, Joaquin; Bauza, Antonio; Frontera, Antonio; Ray, Partha Pratim; Saha, Amrita DALTON TRANSACTIONS 1477-9226 (2017) DOI / 10.1039/c7dt02535a
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Article Exploiting 1,4-naphthoquinone and 3-iodo-1,4-naphthoquinone motifs as anion binding sites by hydrogen or halogen-bonding interactions Navarro-Garcia, Encarnacion; Velasco, Maria D.; Zapata, Fabiola; Bauza, Antonio; Frontera, Antonio; Ramirez de Arellano, Carmen; Caballero, Antonio DALTON TRANSACTIONS 1477-9226 (2019) DOI / 10.1039/c9dt02012h
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Article Halogen and Chalcogen Bond Energies Evaluated Using Electron Density Properties Bauza, Antonio; Frontera, Antonio CHEMPHYSCHEM 1439-4235 (2019) DOI / 10.1002/cphc.201901001
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Article Combined experimental and computational studies on preferential CO2 adsorption over a zinc-based porous framework solid Saha, Debraj; Gayen, Saikat; Maity, Tanmoy; Frontera, Antonio; Ortega-Castro, Joaquin; Leus, Karen; Wang, Guangbo; Van der Voort, Pascal; Brandao, Paula; Koner, Subratanath NEW JOURNAL OF CHEMISTRY 1144-0546 (2020) DOI / 10.1039/c9nj04154k
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Article A series of hydrogen bond mediated dinuclear nickel(II) complexes with reduced Schiff base ligands: An insight into the nature of their short intermolecular hydrogen bonds Mirdya, Saikat; Drew, Michael G. B.; Chandra, Akash Kumar; Banerjee, Abhisek; Frontera, Antonio; Chattopadhyay, Shouvik POLYHEDRON 0277-5387 (2020) DOI / 10.1016/j.poly.2020.114374
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Article Understanding the planar conformations in diarylsubstituted heteroarenes: structural and theoretical insights Zia, Mehwash; Hameed, Shahid; Frontera, Antonio; Irran, Elisabeth; Naseer, Muhammad Moazzam CRYSTENGCOMM (2021) DOI / 10.1039/d1ce00354b
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Article Estimation of conventional C-H center dot center dot center dot pi (arene), unconventional C-H center dot center dot center dot pi (chelate) and C-H center dot center dot center dot pi (thiocyanate) interactions in hetero-nuclear nickel(II)-cadmium(II) com Roy, Sourav; Drew, Michael G. B.; Bauza, Antonio; Frontera, Antonio; Chattopadhyay, Shouvik DALTON TRANSACTIONS 1477-9226 (2017) DOI / 10.1039/c6dt04906k
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Article Importance of R-CF3 center dot center dot center dot O Tetrel Bonding Interactions in Biological Systems Garcia-LLinas, Xavier; Bauza, Antonio; Seth, Saikat K.; Frontera, Antonio JOURNAL OF PHYSICAL CHEMISTRY A 1089-5639 (2017) DOI / 10.1021/acs.jpca.7b06052
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Article Synthetic Modulation of a Chemosensor Affords Target Metal Ion Switch from Zn2+ to Al3+ Naskar, Barnali; Maiti, Dilip K.; Bauza, Antonio; Frontera, Antonio; Prodhan, Chandraday; Chaudhuri, Keya; Goswami, Sanchita CHEMISTRYSELECT 2365-6549 (2017) DOI / 10.1002/slct.201700861
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Article A family of [ Cu2], [ Cu4] and [ Cu5] aggregates: alteration of reaction conditions, ancillary bridges and capping anions Das, Manisha; Craig, Gavin A.; Escudero, Daniel; Murrie, Mark; Frontera, Antonio; Ray, Debashis NEW JOURNAL OF CHEMISTRY 1144-0546 (2018) DOI / 10.1039/c8nj02131g Green accepted
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Article EPR, DFT and electrochemical interpretation of a Cu(II) derivative incorporating a Schiff base precursor Das, Kuheli; Goswami, Sanchita; Beyene, Belete B.; Yibeltal, Amogne W.; Garribba, Eugenio; Frontera, Antonio; Datta, Amitabha POLYHEDRON 0277-5387 (2019) DOI / 10.1016/j.poly.2018.11.058
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Article Structures, photoresponse properties and DNA binding abilities of 4-(4-pyridinyl)-2-pyridone salts Mandal, Tripti; Dey, Arka; Pathak, Sudipta; Islam, Md. Maidul; Konar, Saugata; Ortega-Castro, Joaquin; Seth, Saikat Kumar; Ray, Partha Pratim; Frontera, Antonio; Mukhopadhyay, Subrata RSC ADVANCES (2019) DOI / 10.1039/c9ra00666d Gold DOAJ
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Article Covalent and Non-covalent Noble Gas Bonding Interactions in XeFn Derivatives (n=2-6): A Combined Theoretical and ICSD Analysis Gomila, Rosa M.; Frontera, Antonio FRONTIERS IN CHEMISTRY 2296-2646 (2020) DOI / 10.3389/fchem.2020.00395 Gold DOAJ, Green published
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Article Coordination polymers of manganese(II), cobalt(II), nickel(II) and cadmium(II) decorated with rigid pyrazine-2,3-dicarboxylic acid linker: Synthesis, structural diversity, DFT study and magneto-luminescence properties Sen, Charanjeet; Kumar, Manesh; ul Nisa, Zaib; Ashashi, Nargis Akhter; Frontera, Antonio; Sahoo, Subash Chandra; Sheikh, Haq Nawaz POLYHEDRON 0277-5387 (2020) DOI / 10.1016/j.poly.2020.114629
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Article One-Pot Route to X-perfluoroarenes (X = Br, I) Based on Fe-III-Assisted C-F Functionalization and Utilization of These Arenes as Building Blocks for Crystal Engineering Involving Halogen Bonding Rozhkov, Anton, V; Eliseeva, Anastasiya A.; Baykov, Sergey, V; Galmes, Bartomeu; Frontera, Antonio; Kukushkin, Vadim Yu CRYSTAL GROWTH & DESIGN 1528-7483 (2020) DOI / 10.1021/acs.cgd.0c00606
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Article Bifurcated mu(2)-I center dot center dot center dot(N,O) Halogen Bonding: The Case of (Nitrosoguanidinate)Ni-II Cocrystals with lodine(I)-Based sigma-Hole Donors Efimenko, Zarina M.; Eliseeva, Anastasiya A.; Ivanov, Daniil M.; Galmes, Bartomeu; Frontera, Antonio; Bokach, Nadezhda A.; Kukushkin, Vadim Yu CRYSTAL GROWTH & DESIGN 1528-7483 (2021) DOI / 10.1021/acs.cgd.0c01408
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Article Anion-dependent structural variations and charge transport property analysis of 4 '-(3-pyridyl)-4,2 ':6 ',4 ''-terpyridinium salts Hossain, Anowar; Dey, Arka; Seth, Saikat Kumar; Ray, Partha Pratim; Ortega-Castro, Joaquin; Frontera, Antonio; Mukhopadhyay, Subrata CRYSTENGCOMM (2021) DOI / 10.1039/d1ce00248a
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Article Synthesis and crystal structure of the simultaneous binding of Ni(II) cation and chloride by the protonated 2,4,6 tris-(2-pyridyl)-1,3,5 triazine ligand: theoretical investigations of anion center dot center dot center dot pi, pi center dot center dot cent Pal, Pampi; Das, Kinsuk; Hossain, Anowar; Gomila, Rosa M.; Frontera, Antonio; Mukhopadhyay, Subrata NEW JOURNAL OF CHEMISTRY 1144-0546 (2021) DOI / 10.1039/d1nj01880a
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Article Glutamate carboxypeptidase II as a model system for designing host-guest units: a theoretical approach Frontera, Antonio; Bauza, Antonio ORGANIC & BIOMOLECULAR CHEMISTRY 1477-0520 (2021) DOI / 10.1039/d1ob01209f
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Article Unconventional enclathration of guest adipic acid and energetically significant antiparallel pi-stacked ternary assemblies involving unusual regium-pi (chelate) contacts in phenanthroline-based Ni(II) and Cu(II) compounds-Antiproliferative evaluation and t Nath, Hiren; Sharma, Pranay; Gomila, Rosa M.; Frontera, Antonio; Barcelo-Oliver, Miquel; Verma, Akalesh K.; Dutta, Kasturi; Bhattacharyya, Manjit K. JOURNAL OF MOLECULAR STRUCTURE 0022-2860 (2021) DOI / 10.1016/j.molstruc.2021.131038
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Article Coordination versus spodium bonds in dinuclear Zn(ii) and Cd(ii) complexes with a dithiophosphate ligand Kumar, Pretam; Frontera, Antonio; Pandey, Sushil K. NEW JOURNAL OF CHEMISTRY 1144-0546 (2021) DOI / 10.1039/d1nj03165a
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Article Synthesis, X-ray characterization and theoretical study of all-cis 1,4:2,3:5,8:6,7-tetraepoxynaphthalenes: on the importance of the through-space alpha-effect Le, Anh T.; Tran, Van T. T.; Le, Duan T.; Gomila, Rosa M.; Frontera, Antonio; Zubkov, Fedor, I CRYSTENGCOMM (2021) DOI / 10.1039/d1ce01040a
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Review On the Importance of sigma-Hole Interactions in Crystal Structures Frontera, Antonio; Bauza, Antonio CRYSTALS (2021) DOI / 10.3390/cryst11101205 Gold
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Article X-ray Crystal Structure of a Metalled Double-Helix Generated by Infinite and Consecutive C*-Ag-I-C* (C*: N-1-Hexylcytosine) Base Pairs through Argentophilic and Hydrogen Bond Interactions Terron, Angel; Moreno-Vachiano, Blas; Bauza, Antonio; Garcia-Raso, Angel; Fiol, Juan Jesus; Barcelo-Oliver, Miquel; Molins, Elies; Frontera, Antonio CHEMISTRY-A EUROPEAN JOURNAL 0947-6539 (2017) DOI / 10.1002/chem.201604331
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Article A polynuclear and two dinuclear copper(II) Schiff base complexes: Synthesis, characterization, self-assembly, magnetic property and DFT study Bhattacharyya, Anik; Bauza, Antonio; Sproules, Stephen; Natrajan, Louise S.; Frontera, Antonio; Chattopadhyay, Shouvik POLYHEDRON 0277-5387 (2017) DOI / 10.1016/j.poly.2017.08.010 Green accepted
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Article Cooperative influence of pseudohalides and ligand backbone of Schiff-bases on nuclearity and stereochemistry of cobalt(III) complexes: experimental and theoretical investigation Mandal, Arnab; Dasgupta, Sanchari; Ganguly, Sumi; Bauza, Antonio; Frontera, Antonio; Das, Debasis DALTON TRANSACTIONS 1477-9226 (2017) DOI / 10.1039/c7dt03040a
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Article Effect of temperature and ligand protonation on the electronic ground state in Cu(ii) polymers having unusual secondary interactions: a magnetic and catechol oxidase study Saha, Sandeepta; Biswas, Niladri; Sasmal, Ashok; Gomez-Garcia, Carlos J.; Garribba, Eugenio; Bauza, Antonio; Frontera, Antonio; Pilet, Guillaume; Rosair, Georgina M.; Mitra, Samiran; Choudhury, Chirantan Roy DALTON TRANSACTIONS 1477-9226 (2018) DOI / 10.1039/c8dt02417k
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Article Hydrogen bond mediated intermolecular magnetic coupling in mononuclear high spin iron(iii) Schiff base complexes: synthesis, structure and magnetic study with theoretical insight Basak, Tanmoy; Gomez-Garcia, Carlos J.; Gomila, Rosa M.; Frontera, Antonio; Chattopadhyay, Shouvik RSC ADVANCES (2021) DOI / 10.1039/d0ra09425k Gold
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Article Favipiravir: insight into the crystal structure, Hirshfeld surface analysis and computational study Babashkina, Maria G.; Frontera, Antonio; Kertman, Alexander, V; Saygideger, Yasemin; Murugavel, Swaminathan; Safin, Damir A. JOURNAL OF THE IRANIAN CHEMICAL SOCIETY 1735-207X (2021) DOI / 10.1007/s13738-021-02285-x Bronze
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Article Change in molecular shapes of the trinuclear (Cu2ZnII)-Zn-II complexes on Schiff base reduction: structural and theoretical investigations Hazari, Alokesh; Gomila, Rosa M.; Frontera, Antonio; Drew, Michael G. B.; Ghosh, Ashutosh CRYSTENGCOMM (2021) DOI / 10.1039/d1ce00490e
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Article An insight into the supramolecular interactions in two linear polyvanadates Thakur, Snehasish; Frontera, Antonio; Chattopadhyay, Shouvik JOURNAL OF MOLECULAR STRUCTURE 0022-2860 (2021) DOI / 10.1016/j.molstruc.2021.130681
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Article Synthesis and characterization of a mononuclear zinc(ii) Schiff base complex: on the importance of C-HMIDLINE HORIZONTAL ELLIPSIS pi interactions Basak, Tanmoy; Frontera, Antonio; Chattopadhyay, Shouvik RSC ADVANCES (2021) DOI / 10.1039/d1ra03943a Gold
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Article Coordination complexes of zinc and manganese based on pyridine-2,5-dicarboxylic acid N-oxide: DFT studies and antiproliferative activities consideration Alizadeh, Hanie; Mirzaei, Masoud; Saljooghi, Amir Sh; Jodaian, Vida; Bazargan, Maryam; Mague, Joel T.; Gomila, Rosa M.; Frontera, Antonio RSC ADVANCES (2021) DOI / 10.1039/d1ra08258b Gold
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Article Frustrated Lewis Pairs Based on Carbon...Carbon(+) Tetrel Bonds: A DFT Study De Las Nieves Pina, Maria; Frontera, Antonio; Mooibroek, Tiddo J.; Bauza, Antonio CHEMPHYSCHEM 1439-4235 (2021) DOI / 10.1002/cphc.202100613
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Article Solvent driven structural topologies involving unconventional O-H (methanol)center dot center dot center dot pi contact and anti-cooperative HB center dot center dot center dot anion-pi center dot center dot center dot HB assemblies with unusual enclathrat Dutta, Debasish; Sharma, Pranay; Gomila, Rosa M.; Frontera, Antonio; Barcelo-Oliver, Miquel; Verma, Akalesh K.; Gogoi, Munmi; Bhattacharyya, Manjit K. POLYHEDRON 0277-5387 (2021) DOI / 10.1016/j.poly.2021.115503
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Article A homonuclear pi-system with a singlet carbene-type alpha and a nucleophilic beta phosphorus - the first use in P-heterocyclic synthesis Schmer, Alexander; Welideniya, Dhanushi; Terschueren, Tatjana; Schnakenburg, Gregor; Daniels, Jorg; Bauza, Antonio; Frontera, Antonio; Streubel, Rainer DALTON TRANSACTIONS 1477-9226 (2021) DOI / 10.1039/d1dt03350f
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Article A comparative study of noncovalent interactions in various Ni-compounds containing nitrogen heteroaromatic ligands and pseudohalides: A combined experimental and theoretical studies Jana, Narayan Ch.; Ghorai, Pravat; Brandao, Paula; Bandyopadhyay, Parbati; Saha, Amrita; Frontera, Antonio; Panja, Anangamohan INORGANICA CHIMICA ACTA 0020-1693 (2021) DOI / 10.1016/j.ica.2021.120702
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Article Introducing Supramolecular Interactions into Robust Bis(tetrabromocatecholate) Chelated Manganese(III) Systems and Biomimetic Catalytic Activity Panja, Anangamohan; Jana, Narayan Ch.; Bauza, Antonio; Adak, Sarmistha; Mwania, Tom M.; Eichhorn, David M.; Frontera, Antonio CHEMISTRYSELECT 2365-6549 (2017) DOI / 10.1002/slct.201602007
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Article pi-hole interactions at work: crystal engineering with nitro-derivatives Bauza, Antonio; Sharko, Anastasiya V.; Senchyk, Ganna A.; Rusanov, Eduard B.; Frontera, Antonio; Domasevitch, Kostiantyn V. CRYSTENGCOMM (2017) DOI / 10.1039/c7ce00267j
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Article Synthesis, Characterization, DFT Study, Catechol Oxidase and Phenoxazinone Synthase Like Activities of Two New Manganese(IV) Schiff Base Complexes Sarkar, Nandita; Harms, Klaus; Bauza, Antonio; Frontera, Antonio; Chattopadhyay, Shouvik CHEMISTRYSELECT 2365-6549 (2017) DOI / 10.1002/slct.201601664
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Article On the Importance of p-Hole Beryllium Bonds: Theoretical Study and Biological Implications Bauza, Antonio; Frontera, Antonio CHEMISTRY-A EUROPEAN JOURNAL 0947-6539 (2017) DOI / 10.1002/chem.201700682
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Article Unveiling the effects of the in situ generated arene anion radical and imine radical on catecholase like activity: a DFT supported experimental investigation Dasgupta, Sanchari; Adhikary, Jaydeep; Giri, Sanjib; Bauza, Antonio; Frontera, Antonio; Das, Debasis DALTON TRANSACTIONS 1477-9226 (2017) DOI / 10.1039/c7dt00733g
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Article Bipolar behaviour of salt-bridges: a combined theoretical and crystallographic study Seth, Saikat Kumar; Bauza, Antonio; Frontera, Antonio NEW JOURNAL OF CHEMISTRY 1144-0546 (2018) DOI / 10.1039/c8nj02194e
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Article Multicomponent Supramolecular Assemblies of Melamine and alpha-Hydroxycarboxylic Acids: Understanding the Hydrogen Bonding Patterns and Their Physicochemical Consequences Castineiras, Alfonso; Garcia-Santos, Isabel; Maria Gonzalez-Perez, Josefa; Bauza, Antonio; Zareba, Jan K.; Niclos-Gutierrez, Juan; Torres, Rocio; Vilchez, Esther; Frontera, Antonio CRYSTAL GROWTH & DESIGN 1528-7483 (2018) DOI / 10.1021/acs.cgd.8b01035
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Article closo-Carboranes as dual CHMIDLINE HORIZONTAL ELLIPSIS pi and BHMIDLINE HORIZONTAL ELLIPSIS pi donors: theoretical study and biological significance Frontera, Antonio; Bauza, Antonio PHYSICAL CHEMISTRY CHEMICAL PHYSICS 1463-9076 (2019) DOI / 10.1039/c9cp03858b
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Article Zn(II) and Co(II) derivatives anchored with scorpionate precursor: Antiproliferative evaluation in human cancer cell lines Das, Kuheli; Datta, Amitabha; Frontera, Antonio; Wen, Yuh-Sheng; Roma-Rodrigues, Catarina; Raposo, Luis R.; Fernandes, Alexandra R.; Hung, Chen-Hsiung JOURNAL OF INORGANIC BIOCHEMISTRY 0162-0134 (2020) DOI / 10.1016/j.jinorgbio.2019.110881
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Article Tetrel Bonding and Other Non-Covalent Interactions Assisted Supramolecular Aggregation in a New Pb(II) Complex of an Isonicotinohydrazide Mahmoudi, Ghodrat; Abedi, Marjan; Lawrence, Simon E.; Zangrando, Ennio; Babashkina, Maria G.; Klein, Axel; Frontera, Antonio; Safin, Damir A. MOLECULES (2020) DOI / 10.3390/molecules25184056 Gold DOAJ, Green published
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Article On the importance of RH3 center dot center dot center dot N tetrel bonding interactions in the solid state of a dinuclear zinc complex with a tetradentate Schiff base ligand Mondal, Ipsita; Frontera, Antonio; Chattopadhyay, Shouvik CRYSTENGCOMM (2021) DOI / 10.1039/d0ce01864c
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Article Lead(ii) supramolecular structures formed through a cooperative influence of the hydrazinecarbothioamide derived and ancillary ligands Garcia-Santos, Isabel; Castineiras, Alfonso; Mahmoudi, Ghodrat; Babashkina, Maria G.; Zangrando, Ennio; Gomila, Rosa M.; Frontera, Antonio; Safin, Damir A. CRYSTENGCOMM (2021) DOI / 10.1039/d1ce01251g

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