Computational study of the Grignard reaction with alkynes

Journal of Molecular Structure: THEOCHEM

Volumn 674, Issue 1-3, 2004, Pages 233-239

  Tuulmets, Ants ^a   Tammiku Taul, Jaana ^a   Burk, Peeter ^a  

^a UNIVERSITY OF TARTU   (Estonia)

Author keywords

Alkynes; Density functional theory calculations; Grignard compounds; Transition states

Indexed keywords

ALKYNE DERIVATIVE; BROMINE DERIVATIVE; CHLORINE DERIVATIVE; DIMETHYL ETHER; MAGNESIUM DERIVATIVE;

AB INITIO CALCULATION; ARTICLE; CHEMICAL ANALYSIS; CHEMICAL REACTION; COMPLEX FORMATION; DENSITY FUNCTIONAL THEORY; GRIGNARD REACTION; PHASE TRANSITION; PROTON TRANSPORT; REACTION ANALYSIS; SOLVATION; SUPRAMOLECULAR CHEMISTRY;

EID: 1942532715     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2004.01.015     Document Type: Article

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