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European Journal of Inorganic Chemistry

Volumn , Issue 28, 2012, Pages 4445-4453

A theoretical investigation on the oxidation of carbon monoxide by an aqueous molybdocene

(3) Tílvez, Elkin a Menéndez, María I a López, Ramón a

a UNIVERSITY OF OVIEDO (Spain)

Author keywords

Carbon monoxide; Density functional calculations; Molybdenum; Oxidation; Solvent effects

Indexed keywords

CARBON DIOXIDE; CARBON MONOXIDE; ENERGY BARRIERS; FREE ENERGY; GASES; GIBBS FREE ENERGY; MOLECULES; MOLYBDENUM; OXIDATION; SOLVENTS;

DENSITY-FUNCTIONAL CALCULATIONS; GAS-PHASES; HYDROGEN MIGRATION; HYDROXIDE ATTACKS; NUCLEOPHILIC MECHANISMS; RATE DETERMINING STEP; SOLVENT EFFECTS; THEORETICAL INVESTIGATIONS; WATER MEDIA; WATER SOLUTIONS;

DENSITY FUNCTIONAL THEORY;

EID: 84866668867 PISSN: 14341948 EISSN: 10990682 Source Type: Journal
DOI: 10.1002/ejic.201200602 Document Type: Article

Times cited : (6)

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