A theoretically-guided optimization of a new family of modular P,S-ligands for iridium-catalyzed hydrogenation of minimally functionalized olefins

Chemistry - A European Journal

Volumn 20, Issue 38, 2014, Pages 12201-12214

  Margalef, Jèssica ^a   Caldentey, Xisco ^b   Karlsson, Erik A ^b   Coll, Mercè ^a   Mazuela, Javier ^a   Pàmies, Oscar ^a   Diéguez, Montserrat ^a   Pericàs, Miquel A ^b,c  

^a UNIVERSITAT ROVIRA I VIRGILI   (Spain)

^b INSTITUTE OF CHEMICAL RESEARCH OF CATALONIA ICIQ   (Spain)

^c UNIVERSITY OF BARCELONA   (Spain)

Author keywords

asymmetric synthesis; density functional theory; hydrogenation; iridium; ligands

Indexed keywords

CATALYSIS; CHELATION; DESIGN FOR TESTABILITY; HYDROGENATION; IRIDIUM; IRIDIUM COMPOUNDS; LIGANDS; OLEFINS; SUBSTRATES;

ASYMMETRIC SYNTHESIS; ENANTIOCONTROL; ENANTIOMERIC EXCESS; IRIDIUM COMPLEX; MODULAR LIGANDS; SELECTIVE CATALYSTS; TRANSITION STATE; TRIFLUOROMETHYL;

DENSITY FUNCTIONAL THEORY;

EID: 84920734743     PISSN: 09476539     EISSN: 15213765     Source Type: Journal    
DOI: 10.1002/chem.201402978     Document Type: Article

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