Results: 34
Pau Font, Hugo Valdés, Xavi Ribas
Consolidation of the Oxidant‐Free Au(I)/Au(III) Catalysis Enabled by the Hemilabile Ligand Strategy
Angew Chem Int Ed, 2024, 63, e202405824
DOI: 10.1002/anie.202405824Keywords: Cross-coupling reactions, Homogeneous catalysis, Ligand design, Organometallics
Michele Tomasini, Maria Voccia, Lucia Caporaso, Michal Szostak, Albert Poater
Tuning the steric hindrance of alkylamines: a predictive model of steric editing of planar amines
Chem. Sci., 2024, 15, 13405-13414
DOI: 10.1039/D4SC03873HKeywords: Chemical bonding, Computational chemistry, Cross-coupling reactions, Machine learning, Organometallics
Michele Tomasini, Martí Gimferrer, Lucia Caporaso, Albert Poater
Rhenium Alkyne Catalysis: Sterics Control the Reactivity
Inorg. Chem., 2024, 63, 5842-5851
DOI: 10.1021/acs.inorgchem.3c04235Keywords: Chemical bonding, Computational chemistry, Cross-coupling reactions, Homogeneous catalysis, Reaction mechanisms
Miguel Ramos, Miquel Solà, Albert Poater
Hydrophenoxylation of alkynes by gold catalysts: a mini review
J Mol Model, 2024, 30, ASAP-
DOI: 10.1007/s00894-024-06152-3Keywords: Cross-coupling reactions, Homogeneous catalysis, Ligand design, Organometallics, Reaction mechanisms
Zhaofeng Sun, Jibo Zong, Hongyuan Ren, Changsheng Lu, Deshuang Tu, Jordi Poater, Miquel Solà, Zhuangzhi Shi, Hong Yan
Couple-close construction of non-classical boron cluster-phosphonium conjugates
Nat Commun, 2024, 15, ASAP-
DOI: 10.1038/s41467-024-51506-3Keywords: Aromaticity, Chemical bonding, Cross-coupling reactions, Joint Exp-Comp, Non-covalent interactions
Torsten Beweries, MichaelR. Buchmeiser, NeilR. Champness, Miquel Costas, Anne Duhme-Klair, Jorge Echeverría, Odile Eisenstein, CalumT.J. Ferguson, JoeC. Goodall, Rafael Gramage-Doria, Matthew Gyton, Rens Ham, Sonja Herres-Pawlis, ChloeL. Johnson, Pierre Kennepohl, Bartosz Lewandowski, PimR. Linnebank, StuartA. Macgregor, KamranT. Mahmudov, Eva Meeus, Miquel Navarro, Pinkie Ntola, TatjanaN. Parac-Vogt, RobinN. Perutz, Albert Poater, DavidC. Powers, Sonja Pullen, PaulR. Raithby, JoostN.H. Reek, ThomasR. Ward, AndrewS. Weller, Helma Wennemers
Manipulate – techniques to manipulate the surroundings of a synthetic catalyst to control activity and selectivity: general discussion
Faraday Discuss., 2023, 244, 96-118
DOI: 10.1039/D3FD90013DKeywords: Chemical bonding, Computational chemistry, Cross-coupling reactions, Organometallics, Reaction mechanisms
Shiyi Yang, Xiang Yu, Yaxu Liu, Michele Tomasini, Lucia Caporaso, Albert Poater, Luigi Cavallo, CatherineS.J. Cazin, StevenP. Nolan, Michal Szostak
Suzuki–Miyaura Cross-Coupling of Amides by N–C Cleavage Mediated by Air-Stable, Well-Defined [Pd(NHC)(sulfide)Cl] Catalysts: Reaction Development, Scope, and Mechanism
J. Org. Chem., 2023, 88, 10858-10868
DOI: 10.1021/acs.joc.3c00912Keywords: Computational chemistry, Cross-coupling reactions, Homogeneous catalysis, Organometallics, Reaction mechanisms
Eduardo Jaimes-Romano, Hugo Valdés, Simon Hernández-Ortega, Rosa Mollfulleda, Marcel Swart, David Morales-Morales
C–S Couplings Catalyzed by Ni(II) Complexes of the Type [(NHC)Ni(Cp)(Br)]
Journal of Catalysis, 2023, 426, 247-256
DOI: 10.1016/j.jcat.2023.07.001Keywords: Computational chemistry, Cross-coupling reactions, Homogeneous catalysis, Reaction mechanisms, Spin states
Pau Font, Hugo Valdés, Gregorio Guisado-Barrios, Xavi Ribas
Hemilabile MIC^N ligands allow oxidant-free Au(
Chem. Sci., 2022, 13, 9351-9360
DOI: 10.1039/D2SC01966CKeywords: Catalysis, Cross-coupling reactions, High-valent metal complexes, Organometallics
Hugo Valdés, Juan M. Germán-Acacio, Gerard van Koten, David Morales-Morales
Bimetallic complexes that merge metallocene and pincer-metal building blocks: synthesis, stereochemistry and catalytic reactivity
Dalton Trans., 2022, 51, 1724-1744
DOI: 10.1039/D1DT03870BKeywords: Catalysis, Cross-coupling reactions, Organometallics