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Journal of Molecular Structure: THEOCHEM

Volumn 544, Issue 1-3, 2001, Pages 141-150

Effect of heteroatoms in determining the rotational barrier around carbon-carbon double bond in substituted ethylenes. An MO ab initio theoretical study

(1) Taddei, Ferdinando a

a UNIVERSITY OF MODENA AND REGGIO EMILIA (Italy)

Author keywords

Heterocyclic derivatives; MO ab initio calculations; Push pull ethylenes; Rotational barriers; Substituent effect

Indexed keywords

ETHYLENE; HETEROCYCLIC COMPOUND;

ARTICLE; CALCULATION; CONFORMATION; ELECTRON TRANSPORT; EXTRACTION; HYPERPOLARIZATION; THEORY;

EID: 0035796604 PISSN: 01661280 EISSN: None Source Type: Journal
DOI: 10.1016/S0166-1280(01)00373-6 Document Type: Article

Times cited : (11)

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