Chemistry
Listando 33 trabajos del autor/autora 38
Lista de trabajos en el área Chemistry
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Article
The Chemical Bond: When Atom Size Instead of Electronegativity Difference Determines Trend in Bond Strength
Blokker, Eva; Sun, Xiaobo; Poater, Jordi; van der Schuur, J. Martijn; Hamlin, Trevor A.; Bickelhaupt, F. Matthias
CHEMISTRY-A EUROPEAN JOURNAL
0947-6539 (2021)
DOI /
10.1002/chem.202103544
Hybrid
Mentions
30
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0
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0
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Article
Path-dependency of energy decomposition analysis & the elusive nature of bonding
Poater, Jordi; Andrada, Diego M.; Sola, Miquel; Foroutan-Nejad, Cina
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
(2021)
DOI /
10.1039/d1cp04135e
Mentions
15
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0
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1
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0
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Article
Carbon monoxide insertion at a heavy p-block element: unprecedented formation of a cationic bismuth carbamoyl
Ramler, Jacqueline; Poater, Jordi; Hirsch, Florian; Ritschel, Benedikt; Fischer, Ingo; Matthias Bickelhaupt, F.; Lichtenberg, Crispin
CHEMICAL SCIENCE
2041-6520 (2019)
DOI /
10.1039/c9sc00278b
Green published, Gold
Mentions
10
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0
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3
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Article
Double CH Activation of a Masked Cationic Bismuth Amide
Ritschel, Benedikt; Poater, Jordi; Dengel, Hannah; Bickelhaupt, F. Matthias; Lichtenberg, Crispin
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
1433-7851 (2018)
DOI /
10.1002/anie.201712725
Mentions
12
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0
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0
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0
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Article
PyFrag 2019-Automating the Exploration and Analysis of Reaction Mechanisms
Sun, Xiaobo; Soini, Thomas M.; Poater, Jordi; Hamlin, Trevor A.; Bickelhaupt, F. Matthias
JOURNAL OF COMPUTATIONAL CHEMISTRY
0192-8651 (2019)
DOI /
10.1002/jcc.25871
Green published, Hybrid
Mentions
8
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0
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1
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Article
Bismuth Amides Mediate Facile and Highly Selective Pn-Pn Radical-Coupling Reactions (Pn=N, P, As)
Oberdorf, Kai; Hanft, Anna; Ramler, Jacqueline; Krummenacher, Ivo; Bickelhaupt, F. Matthias; Poater, Jordi; Lichtenberg, Crispin
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
1433-7851 (2021)
DOI /
10.1002/anie.202015514
Gold other, Green published
Mentions
29
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Article
Zwitterionic Aromaticity on Azulene Extrapolated to carbo-Azulene
Poater, Jordi; Heitkaemper, Juliane; Poater, Albert; Maraval, Valerie; Chauvin, Remi
EUROPEAN JOURNAL OF ORGANIC CHEMISTRY
1434-193X (2021)
DOI /
10.1002/ejoc.202101228
Mentions
23
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Article
Too Persistent to Give Up: Aromaticity in Boron Clusters Survives Radical Structural Changes
Poater, Jordi; Vinas, Clara; Bennour, Ines; Escayola Gordils, Silvia; Sola, Miquel; Teixidor, Francesc
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
0002-7863 (2020)
DOI /
10.1021/jacs.0c02228
Green accepted
Mentions
18
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0
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Article
Open-shell jellium aromaticity in metal clusters
Poater, Jordi; Sola, Miquel
CHEMICAL COMMUNICATIONS
1359-7345 (2019)
DOI /
10.1039/c9cc02067e
Green accepted
Mentions
28
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0
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Article
Distortion-Controlled Redshift of Organic Dye Molecules
Narsaria, Ayush K.; Poater, Jordi; Guerra, Celia Fonseca; Ehlers, Andreas W.; Hamlin, Trevor A.; Lammertsma, Koop; Bickelhaupt, F. Matthias
CHEMISTRY-A EUROPEAN JOURNAL
0947-6539 (2020)
DOI /
10.1002/chem.201905355
Green published, Hybrid
Mentions
17
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Article
para-Selective C-H Olefination of Aniline Derivatives via Pd/S,O-Ligand Catalysis
Naksomboon, Kananat; Poater, Jordi; Bickelhaupt, F. Matthias; Fernandez-Ibanez, M. Angeles
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
0002-7863 (2019)
DOI /
10.1021/jacs.9b01908
Green published, Hybrid
Mentions
4
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0
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0
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0
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Article
The energy components of the extended transition state energy decomposition analysis are path functions: the case of water tetramer
Sola, Miquel; Duran, Miquel; Poater, Jordi
THEORETICAL CHEMISTRY ACCOUNTS
1432-881X (2021)
DOI /
10.1007/s00214-021-02730-3
Mentions
26
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0
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Analysis of the electronic delocalization in some isoelectronic analogues of B-12 doped with beryllium and/or carbon
Islas, Rafael; Inostroza, Diego; Arias-Olivares, David; Zuniga-Gutierrez, Bernardo; Poater, Jordi; Sola, Miquel
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
1463-9076 (2020)
DOI /
10.1039/d0cp01844a
Green accepted
Mentions
19
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0
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Article
The nido-Cage...pi Bond: A Non-covalent Interaction between Boron Clusters and Aromatic Rings and Its Applications
Tu, Deshuang; Yan, Hong; Poater, Jordi; Sola, Miquel
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
1433-7851 (2020)
DOI /
10.1002/anie.201915290
Green submitted
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0
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Article
Stabilization of 2,6-Diarylanilinum Cation by Through-Space Cation-pi Interactions
Padial, Joan Simo; Poater, Jordi; Nguyen, D. Thao; Tinnemans, Paul; Bickelhaupt, F. Matthias; Mecinovic, Jasmin
JOURNAL OF ORGANIC CHEMISTRY
0022-3263 (2017)
DOI /
10.1021/acs.joc.7b01406
Green published, Gold other
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0
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0
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Article
Covalent and Ionic Capacity of MOFs To Sorb Small Gas Molecules
Poater, Jordi; Gimferrer, Marti; Poater, Albert
INORGANIC CHEMISTRY
0020-1669 (2018)
DOI /
10.1021/acs.inorgchem.8b00670
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0
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0
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Article
Comparison of Molecular Recognition of Trimethyllysine and Trimethylthialysine by Epigenetic Reader Proteins
Hintzen, Jordi C. J.; Poater, Jordi; Kumar, Kiran; Al Temimi, Abbas H. K.; Pieters, Bas J. G. E.; Paton, Robert S.; Bickelhaupt, F. Matthias; Mecinovic, Jasmin
MOLECULES
(2020)
DOI /
10.3390/molecules25081918
Gold, Green published
Mentions
6
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0
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Mechanism of biomolecular recognition of trimethyllysine by the fluorinated aromatic cage of KDM5A PHD3 finger
Pieters, Bas J. G. E.; Wuts, Maud H. M.; Poater, Jordi; Kumar, Kiran; White, Paul B.; Kamps, Jos J. A. G.; Sherman, Woody; Pruijn, Ger J. M.; Paton, Robert S.; Beuming, Thijs; Bickelhaupt, F. Matthias; Mecinovic, Jasmin
COMMUNICATIONS CHEMISTRY
2399-3669 (2020)
DOI /
10.1038/s42004-020-0313-2
Green published, Gold
Mentions
6
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0
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Article
Do Sulfonamides Interact with Aromatic Rings?
Jian, Jie; Hammink, Roel; McKenzie, Christine J.; Bickelhaupt, F. Matthias; Poater, Jordi; Mecinovic, Jasmin
CHEMISTRY-A EUROPEAN JOURNAL
0947-6539 (2021)
DOI /
10.1002/chem.202004732
Mentions
9
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0
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Article
B-DNA model systems in non-terran bio-solvents: implications for structure, stability and replication
Hamlin, Trevor A.; Poater, Jordi; Guerra, Celia Fonseca; Bickelhaupt, F. Matthias
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
1463-9076 (2017)
DOI /
10.1039/c7cp01908d
Mentions
5
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0
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Article
Phenoxylation of Alkynes through Mono- and Dual Activation Using Group 11 (Cu, Ag, Au) Catalysts
Ramos, Miguel; Poater, Jordi; Villegas-Escobar, Nery; Gimferrer, Marti; Toro-Labbe, Alejandro; Cavallo, Luigi; Poater, Albert
EUROPEAN JOURNAL OF INORGANIC CHEMISTRY
1434-1948 (2020)
DOI /
10.1002/ejic.201901220
Green submitted
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5
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0
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Article
Chelation enforcing a dual gold configuration in the catalytic hydroxyphenoxylation of alkynes
Escayola, Silvia; Poater, Jordi; Ramos, Miguel; Luque-Urrutia, Jesus Antonio; Duran, Josep; Simon, Silvia; Sola, Miquel; Cavallo, Luigi; Nolan, Steven P.; Poater, Albert
APPLIED ORGANOMETALLIC CHEMISTRY
0268-2605 (2021)
DOI /
10.1002/aoc.6362
Hybrid, Green published
Mentions
4
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0
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0
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Article
Nature of the Ru-NO Coordination Bond: Kohn-Sham Molecular Orbital and Energy Decomposition Analysis
Orenha, Renato P.; Rocha, Marcus V. J.; Poater, Jordi; Galembeck, Sergio E.; Bickelhaupt, F. Matthias
CHEMISTRYOPEN
2191-1363 (2017)
DOI /
10.1002/open.201700028
Green published, Gold
Mentions
12
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0
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0
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Article
Understanding the differences between iron and palladium in cross-coupling reactions
Sun, Xiaobo; Rocha, Marcus V. J.; Hamlin, Trevor A.; Poater, Jordi; Bickelhaupt, F. Matthias
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
1463-9076 (2019)
DOI /
10.1039/c8cp07671e
Green published
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4
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0
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Article
Testing the effectiveness of the isoelectronic substitution principle through the transformation of aromatic osmathiophene derivatives into their inorganic analogues
Vasquez-Espinal, Alejandro; Poater, Jordi; Sola, Miquel; Tiznado, William; Islas, Rafael
NEW JOURNAL OF CHEMISTRY
1144-0546 (2017)
DOI /
10.1039/c6nj02972h
Green accepted
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4
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Article
Formation of a Trifluorophosphane Platinum(II) Complex by P-F Bond Activation of Phosphorus Pentafluoride with a Pt-0 Complex
Arnold, Nicole; Bertermann, Ruediger; Bickelhaupt, F. Matthias; Braunschweig, Holger; Drisch, Michael; Finze, Maik; Hupp, Florian; Poater, Jordi; Sprenger, Jan A. P.
CHEMISTRY-A EUROPEAN JOURNAL
0947-6539 (2017)
DOI /
10.1002/chem.201604997
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4
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0
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Article
Aromaticity Determines the Relative Stability of Kinked vs. Straight Topologies in Polycyclic Aromatic Hydrocarbons
Poater, Jordi; Duran, Miquel; Sola, Miquel
FRONTIERS IN CHEMISTRY
2296-2646 (2018)
DOI /
10.3389/fchem.2018.00561
Gold DOAJ, Green published
Mentions
3
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0
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Article
Cyclopropenylidenephosphoranes: Rearrangement to Azetidinylidene-Methylphosphoniums
Mboyi, Cleve Dionel; Poater, Albert; Poater, Jordi; Duhayon, Carine; Chauvin, Remi
JOURNAL OF ORGANIC CHEMISTRY
0022-3263 (2020)
DOI /
10.1021/acs.joc.0c00847
Mentions
1
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0
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0
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Article
Recognition of shorter and longer trimethyllysine analogues by epigenetic reader proteins
Al Temimi, Abbas H. K.; Belle, Roman; Kumar, Kiran; Poater, Jordi; Betlem, Peter; Pieters, Bas J. G. E.; Paton, Robert S.; Bickelhaupt, F. Matthias; Mecinovic, Jasmin
CHEMICAL COMMUNICATIONS
1359-7345 (2018)
DOI /
10.1039/c8cc01009a
Green submitted
Mentions
1
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Silylene-Induced Reduction of [Mn-2(CO)(10)]: Formation of a Five-Coordinate Silicon(IV) Complex with an O-Bound [(OC)(4)Mn=Mn(CO)(4)](2-)Ligand
Baus, Johannes A.; Poater, Jordi; Bickelhaupt, F. Matthias; Tacke, Reinhold
EUROPEAN JOURNAL OF INORGANIC CHEMISTRY
1434-1948 (2017)
DOI /
10.1002/ejic.201600913
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0
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0
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Article
Rational design of near-infrared absorbing organic dyes: Controlling the HOMO-LUMO gap using quantitative molecular orbital theory
Narsaria, Ayush K.; Poater, Jordi; Guerra, Celia Fonseca; Ehlers, Andreas W.; Lammertsma, Koop; Bickelhaupt, F. Matthias
JOURNAL OF COMPUTATIONAL CHEMISTRY
0192-8651 (2018)
DOI /
10.1002/jcc.25731
Green published, Hybrid
Mentions
1
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0
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Article
Probing Halogen-pi versus CH-pi Interactions in Molecular Balance
Jian, Jie; Poater, Jordi; White, Paul B.; McKenzie, Christine J.; Bickelhaupt, F. Matthias; Mecinovic, Jasmin
ORGANIC LETTERS
1523-7060 (2020)
DOI /
10.1021/acs.orglett.0c02773
Mentions
1
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0
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Article
Through-Space Polar-pi Interactions in 2,6-Diarylthiophenols
Jian Jie; Poater, Jordi; Hammink, Roel; Tinnemans, Paul; McKenzie, Christine J.; Bickelhaupt, F. Matthias; Mecinovic, Jasmin
CHEMPHYSCHEM
1439-4235 (2020)
DOI /
10.1002/cphc.202000132
Green published, Hybrid
