Computational insight into the mechanism of selective imine formation from alcohol and amine catalyzed by the ruthenium(II)-PNP pincer complex

European Journal of Inorganic Chemistry

Volumn , Issue 31, 2012, Pages 5011-5020

  Li, Haixia ^a   Wang, Xiaotai ^b   Wen, Mingwei ^a   Wang, Zhi Xiang ^a  

^a UNIVERSITY OF CHINESE ACADEMY OF SCIENCES   (China)

^b UNIVERSITY OF COLORADO   (United States)

Author keywords

Dehydrogenation; Dehydrogenative coupling; Density functional calculations; Imine synthesis; Reaction mechanisms

Indexed keywords

ALDEHYDES; AMIDES; CATALYSIS; CATALYSTS; CHEMICAL BONDS; COMPUTATION THEORY; DEHYDRATION; DEHYDROGENATION; ESTERS; KETONES; KINETICS; PYRIDINE; RUTHENIUM COMPOUNDS;

ALCOHOL DEHYDROGENATION; AMIDE FORMATION; DEHYDROGENATIVE COUPLING; DENSITY-FUNCTIONAL CALCULATIONS; HEMIACETALS; IMINE SYNTHESIS; PINCER COMPLEXES; REACTION MECHANISM; STAGE I; STAGE III;

DENSITY FUNCTIONAL THEORY;

EID: 84867815137     PISSN: 14341948     EISSN: 10990682     Source Type: Journal    
DOI: 10.1002/ejic.201200473     Document Type: Article

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