Theoretical study on the mechanism of iron carbonyls mediated isomerization of allylic alcohols to saturated carbonyls

Chemistry - A European Journal

Volumn 9, Issue 9, 2003, Pages 2062-2067

  Branchadell, Vicenç ^a   Crévisy, Christophe ^b   Grée, René ^b  

^a UNIVERSITAT AUTÒNOMA DE BARCELONA   (Spain)

^b UNIV RENNES   (France)

Author keywords

Allylic compounds; Density functional calculations; Homogeneous catalysis; Iron carbonyls; Isomerization

Indexed keywords

CATALYSIS; GIBBS FREE ENERGY; IRON COMPOUNDS; ISOMERIZATION;

HYDROGEN SHIFTS;

ALCOHOLS;

ALDEHYDE; ALLYL ALCOHOL; CARBONYL DERIVATIVE; CARBONYL IRON;

ARTICLE; CALCULATION; CATALYSIS; CHEMICAL REACTION; COMPLEX FORMATION; ENERGY TRANSFER; ISOMERISM; REACTION ANALYSIS; THEORETICAL STUDY;

EID: 0038814021     PISSN: 09476539     EISSN: None     Source Type: Journal    
DOI: 10.1002/chem.200204567     Document Type: Article

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