Markedly different selectivity in the rhodium catalyzed hydroformylation of vinyl olefins containing a chiral alkoxy or alkyl group: Good agreement between theory and experiment

Inorganica Chimica Acta

Volumn 357, Issue 10, 2004, Pages 2980-2988

  Alagona, Giuliano ^a   Ghio, Caterina ^a   Lazzaroni, Raffaello ^b   Settambolo, Roberta ^c  

^a CNR   (Italy)

^b UNIVERSITY OF PISA   (Italy)

^c I 56126   (Italy)

Author keywords

B3LYP SBK(d); DFT calculations; Diastereoselectivity; Gas phase stability; Isomeric alkyl rhodium intermediates; Regioselectivity; Unmodified Rh catalysts

Indexed keywords

ALDEHYDES; BENZENE; CATALYSTS; GROUP THEORY; HYDROFORMYLATION; ISOMERS; OLEFINS; REGIOSELECTIVITY; RHODIUM COMPOUNDS; STEREOSELECTIVITY;

B3LYP/SBK(D); DFT CALCULATION; DIASTEREO-SELECTIVITY; GAS-PHASE STABILITY; ISOMERIC ALKYL RHODIUM INTERMEDIATES; RH CATALYSTS;

REACTION INTERMEDIATES;

(1 METHYLBUT 3 ENYL)BENZENE; (1 VINYLOXYETHYL)BENZENE; ALDEHYDE; ALKENE DERIVATIVE; ALKYL GROUP; BENZENE DERIVATIVE; RHODIUM; UNCLASSIFIED DRUG; VINYL DERIVATIVE;

ARTICLE; CALCULATION; CATALYSIS; CATALYST; CHIRALITY; DIASTEREOISOMER; HYDROFORMYLATION; ISOMERIZATION; PREDICTION; ROOM TEMPERATURE; STEREOCHEMISTRY; SURFACE PROPERTY;

EID: 3242656291     PISSN: 00201693     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.ica.2004.02.025     Document Type: Article

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