Conformational and vibrational study of di-n-butyl and di-sec-butylphosphonates by MM/QM method

International Journal of Quantum Chemistry

Volumn 106, Issue 13, 2006, Pages 2633-2642

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

^a FLUMINENSE FEDERAL UNIVERSITY   (Brazil)

Author keywords

Conformational search; Dialkylphosphonates; Infrared; MM QM; Raman

Indexed keywords

CONFORMATIONS; INFRARED RADIATION; MOLECULAR VIBRATIONS; NATURAL FREQUENCIES; RAMAN SPECTROSCOPY;

CONFORMATIONAL SEARCH; DIALKYLPHOSPHONATES; SPECTRAL ASSIGNMENT; VIBRATIONAL ASSIGNMENTS;

PHOSPHATES;

EID: 33749168353     PISSN: 00207608     EISSN: 1097461X     Source Type: Journal    
DOI: 10.1002/qua.21081     Document Type: Conference Paper

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