Vibrational spectra and potential energy distributions for 3- cyclopropenecarboxaldehyde by density functional and normal coordinate calculations

Journal of Molecular Structure: THEOCHEM

Volumn 507, Issue 1-3, 2000, Pages 207-215

  Badawi, H M ^a   Forner W ^a  

^a KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS   (Saudi Arabia)

Author keywords

3 Cyclopropenecarboxaldehyde; Ab initio calculations; Rotational barrier; Vibrational frequencies and spectra

Indexed keywords

ALDEHYDE DERIVATIVE; CYCLOALKENE;

ARTICLE; CALCULATION; CHEMICAL STRUCTURE; CONFORMATION; MOLECULAR DYNAMICS; MOLECULAR STABILITY; THERMODYNAMICS; VIBRATION;

EID: 0343090745     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0166-1280(99)00395-4     Document Type: Article

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