Conformational and vibrational study of Di-n-propyl and Di-i-propylphosphonates by MM/QM method

International Journal of Quantum Chemistry

Volumn 103, Issue 5, 2005, Pages 763-774

  Carauta, Alexandre N M ^a   De M Carneiro, José Walkimar ^a   Téllez Soto, Claudio A ^a  

^a FLUMINENSE FEDERAL UNIVERSITY   (Brazil)

Author keywords

Conformational search; Dialkylphosphonates; Infrared; MM QM; Raman

Indexed keywords

CHEMICAL BONDS; CONFORMATIONS; INFRARED SPECTROSCOPY; MOLECULAR VIBRATIONS; ORGANIC ACIDS; PROBABILITY DENSITY FUNCTION; RAMAN SPECTROSCOPY;

CONFORMATIONAL SEARCH; DIALKYLPHOSPHONATES; MM/QM; RAMAN;

PHOSPHORUS COMPOUNDS;

EID: 20844458549     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/qua.20546     Document Type: Conference Paper

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