Co-C dissociation of adenosylcobalamin (Coenzyme B12): Role of dispersion, induction effects, solvent polarity, and relativistic and thermal corrections

Journal of Physical Chemistry A

Volumn 118, Issue 34, 2014, Pages 7104-7117

  Kepp, Kasper P ^a  

^a TECHNICAL UNIVERSITY OF DENMARK   (Denmark)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL BONDS; ORGANOMETALLICS; QUANTUM CHEMISTRY; SOLVENTS;

BASIS SET SUPERPOSITION ERRORS; DISPERSION INTERACTION; PHYSICAL INTERACTIONS; RELATIVISTIC EFFECTS; SIDE-CHAIN INTERACTIONS; SINGLE-POINT ENERGY; THERMAL CORRECTION; VIBRATIONAL EFFECTS;

DISPERSIONS;

CARBON; COBALT; COBAMAMIDE; SOLVENT;

CHEMICAL MODEL; CHEMISTRY; QUANTUM THEORY; TEMPERATURE;

CARBON; COBALT; COBAMIDES; MODELS, CHEMICAL; QUANTUM THEORY; SOLVENTS; TEMPERATURE;

EID: 84906834795     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp503607k     Document Type: Article

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