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Results: 1856

Gabriel Merino, Miquel Solà, Israel Fernandez, Cina Foroutan-Nejad, Paolo Lazzeretti, Gernot Frenking, HarryLaurence Anderson, Dage Sundholm, Fernando Cossio, Marina A. Petrukhina, Jishan Wu, Judy Wu, Albeiro Restrepo
Aromaticity: Quo Vadis
Chem. Sci., 2023, 14, 5569-5576
DOI: 10.1039/D2SC04998H
OpenAccess: Link
Keywords: Aromaticity, Chemical bonding

Miquel Solà, Israel Fernández, Gabriel Merino
Emerging frontiers in aromaticity
Chem. Sci., 2023, 14, 9628-9629
DOI: 10.1039/d3sc90163g
OpenAccess: Link
Keywords: Aromaticity

Kevin Bevernaege, Nikolaos V. Tzouras, Albert Poater, Luigi Cavallo, Steven P. Nolan, Fady Nahra, Johan M. Winne
Site selective gold(i )-catalysed benzylic C–H aminationvia an intermolecular hydride transfer to triazolinediones
Chem. Sci., 2023, 14, 9787-9794
DOI: 10.1039/D3SC03683A
OpenAccess: Link
Keywords: Chemical bonding, Computational chemistry, Homogeneous catalysis, Joint Exp-Comp, Organometallics

Johann B. Kasper, Pattama Saisaha, Maurits de Roo, Mitchell J. Groen, Laia Vicens, Margarida Borrell, Johannes W. de Boer, Ronald Hage, Miquel Costas, Wesley R. Browne
A Common Active Intermediate in the Oxidation of Alkenes, Alcohols and Alkanes with H₂ O₂ and a Mn(II)/Pyridin‐2‐Carboxylato Catalyst
ChemCatChem, 2023, 15, e202201072
DOI: 10.1002/cctc.202201072
OpenAccess: Link
Keywords: Catalysis, Oxidation, Reaction mechanisms, Spectroscopy, Sustainable Catalysis

Anna Vidal-López, Sergio Posada-Pérez, Miquel Solà, Albert Poater
Au Single Metal Atom for Carbon Dioxide Reduction Reaction
Chemistry, 2023, 5, 1395-1406
DOI: 10.3390/chemistry5020095
OpenAccess: Link
Keywords: Computational chemistry, Homogeneous catalysis, Predictive Chemistry, Reaction mechanisms, Sustainable Catalysis

Julia Heitkämper, Sergio Posada, Sílvia Escayola, Miquel Solà, Johannes Kästner, Albert Poater
A non expected alternative Ni(0) Species in the Ni‐Catalytic Aldehyde and Alcohol Arylation Reactions Facilitated by a 1,5‐Diaza‐3,7‐diphosphacyclooctane Ligand
Chemistry A European J, 2023, 29, e202300193
DOI: 10.1002/chem.202300193
OpenAccess: Link
Keywords: Aromaticity, Catalysis, Computational chemistry, Organometallics, Reaction mechanisms

Gibu George, Olga A. Stasyuk, Alexander A. Voityuk, Antony J. Stasyuk, Miquel Solà
Excited state processes in supramolecular complexes of cyclic dibenzopyrrolopyrroles isomers with C60 fullerene
Chemistry A European J, 2023, 29, e202300503
DOI: 10.1002/chem.202300503
OpenAccess: Link
Keywords: Aromaticity, Electron and energy transfer, Excited states, Photovoltaic materials, Supramolecular chemistry

Benon P. Maliszewski, Tahani A. C. A. Bayrakdar, Perrine Lambert, Lama Hamdouna, Xavier Trivelli, Luigi Cavallo, Albert Poater, Marek Beliš, Olivier Lafon, Kristof Van Hecke, Dominic Ormerod, Catherine S. J. Cazin, Fady Nahra, Steven P. Nolan
Pt^II −N‐Heterocyclic Carbene Complexes in Solvent‐Free Alkene Hydrosilylation
Chemistry A European J, 2023, 29, e202301259
DOI: 10.1002/chem.202301259
OpenAccess: –
Keywords: Chemical bonding, Computational chemistry, Homogeneous catalysis, Organometallics, Reaction mechanisms

Aliona G. Baradzenka, Sergei F. Vyboishchikov, Melanie Pilkington, Georgii Nikonov
Base‐stabilized phosphinidene oxide, imide and sulfide
Chemistry A European J, 2023, 29, e202301842
DOI: 10.1002/chem.202301842
OpenAccess: –
Keywords: Computational chemistry, Joint Exp-Comp, Organometallics, Reaction mechanisms

Kazuki Nakanishi, LeonardoI. Lugo-Fuentes, Jun Manabe, Ronghao Guo, Soichi Kikkawa, Seiji Yamazoe, Kenji Komaguchi, Shoko Kume, DariuszW. Szczepanik, Miquel Solà, J.OscarC. Jimenez-Halla, Sadafumi Nishihara, Kazuyuki Kubo, Yohsuke Yamamoto, Masaaki Nakamoto, Tsutomu Mizuta, Rong Shang
Redox Activity of IrIII Complexes with Multidentate Ligands Based on Dipyrido‐annulated N‐Heterocyclic Carbenes: Access to High Valent and High Spin State with Carbon Donors
Chemistry A European J, 2023, 29, e202302303
DOI: 10.1002/chem.202302303
OpenAccess: –
Keywords: High-valent metal complexes, Organometallics, Oxidation, Spin states