Ligand effects on the regioselectivity of rhodium-catalyzed hydroformylation: Density functional calculations illuminate the role of long-range noncovalent interactions

Organometallics

Volumn 33, Issue 16, 2014, Pages 4183-4191

  Kumar, Manoj ^a   Chaudhari, Raghunath V ^a,b   Subramaniam, Bala ^a,b   Jackson, Timothy A ^a  

^a UNIVERSITY OF KANSAS   (United States)

^b University of Kansas   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AROMATIC COMPOUNDS; CATALYSIS; DENSITY FUNCTIONAL THEORY; HYDROFORMYLATION; IONS; OLEFINS; PHOSPHORUS COMPOUNDS; REGIOSELECTIVITY; RHODIUM; STYRENE; SUBSTRATES;

BIDENTATE LIGANDS; DEGREE OF ACCURACY; DENSITY FUNCTIONALS; DISPERSION CORRECTION; ELECTRONIC EFFECTS; NON-COVALENT INTERACTION; NON-LOCAL INTERACTIONS; RHODIUM-CATALYZED HYDROFORMYLATION;

LIGANDS;

EID: 84906568962     PISSN: 02767333     EISSN: 15206041     Source Type: Journal    
DOI: 10.1021/om500196g     Document Type: Article

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