Vibrational spectrum, ab initio calculation, conformational equilibria and torsional modes of 1,3-dibromopropane

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 61, Issue 7, 2005, Pages 1547-1557

  Nalewanski, Matthew S ^a   Tambouret, Yann P ^a   Lentini, Scott T ^a   Stidham, Howard D ^a   Guirgis, Gamil A ^b  

^a UNIVERSITY OF MASSACHUSETTS   (United States)

^b School of Business   (United States)

Author keywords

Ab initio calculations; Conformational equilibria 1,3 dibromopropane; Vibrational spectrum

Indexed keywords

BAND STRUCTURE; COMPUTATION THEORY; CONFORMATIONS; CORRELATION METHODS; CRYSTALLINE MATERIALS; ERROR ANALYSIS; GAUSSIAN NOISE (ELECTRONIC); INFRARED RADIATION; PERTURBATION TECHNIQUES; RAMAN SPECTROSCOPY; SPECTRUM ANALYSIS; TORSIONAL STRESS;

1,3-DIBROMOPROPANE; AB INITIO CALCULATIONS; CONFORMATIONAL EQUILIBRIA; VIBRATIONAL SPECTRUM;

PROPANE;

1,3 DIBROMOPROPANE; 1,3-DIBROMOPROPANE; DRUG DERIVATIVE; PROPANE;

ARTICLE; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; CONFORMATION; CRYSTALLIZATION; ELECTRON; METHODOLOGY; NORMAL DISTRIBUTION; RAMAN SPECTROMETRY; TEMPERATURE; VIBRATION;

CRYSTALLIZATION; ELECTRONS; MODELS, CHEMICAL; MODELS, MOLECULAR; MOLECULAR CONFORMATION; NORMAL DISTRIBUTION; PROPANE; SPECTRUM ANALYSIS, RAMAN; TEMPERATURE; VIBRATION;

EID: 16244423283     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2004.11.060     Document Type: Article

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