Density functional study of the oxidative addition step in the carbonylation of methanol catalyzed by [M(CO)2I2] (M = Rh, Ir)

Organometallics

Volumn 24, Issue 13, 2005, Pages 3053-3058

  Cheong, Minserk ^a   Ziegler, Tom ^b  

^a Kyung Hee University   (South Korea)

^b UNIVERSITY OF CALGARY   (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

ACTIVATION ANALYSIS; CARBONYLATION; CHEMICAL BONDS; COMPUTERIZED TOMOGRAPHY; FORMING; IRIDIUM; OXIDATION; PROBABILITY DENSITY FUNCTION; QUANTUM THEORY; RHODIUM; THERMODYNAMICS;

ACETIC ANHYDRIDE; MONSANTO PROCESS; OXIDATIVE ADDITION REACTION; THERMODYNAMIC ENERGY DIFFERENCE;

METHANOL;

EID: 23144461268     PISSN: 02767333     EISSN: None     Source Type: Journal    
DOI: 10.1021/om049383q     Document Type: Article

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