Matrix-isolation FT-IR spectra and theoretical study of dimethyl sulfate

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 61, Issue 7, 2005, Pages 1461-1470

  Borba, Ana ^a   Gómez Zavaglia, Andrea ^a,b   Simões, Pedro N N L ^a   Fausto, Rui ^a  

^a UNIVERSITY OF COIMBRA   (Portugal)

^b UNIVERSIDAD DE BUENOS AIRES   (Argentina)

Author keywords

Conformational and vibrational analysis; DFT and MP2 calculations; Dimethyl sulfate; FT IR matrix isolation spectroscopy

Indexed keywords

ANNEALING; FOURIER TRANSFORM INFRARED SPECTROSCOPY; HEATING; MOLECULAR VIBRATIONS; POTENTIAL ENERGY; PROBABILITY DENSITY FUNCTION; RAMAN SPECTROSCOPY; THERMAL EFFECTS;

CONFORMATIONAL AND VIBRATIONAL ANALYSIS; DFT AND MP2 CALCULATIONS; DIMETHYL SULFATE; FT-IR MATRIX-ISOLATION SPECTROSCOPY;

SULFUR COMPOUNDS;

ARGON; DIMETHYL SULFATE; SULFATE;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER PROGRAM; CONFORMATION; INFRARED SPECTROPHOTOMETRY; INFRARED SPECTROSCOPY; METHODOLOGY; NORMAL DISTRIBUTION; TEMPERATURE; THEORETICAL MODEL; THERMODYNAMICS;

ARGON; MODELS, MOLECULAR; MODELS, THEORETICAL; MOLECULAR CONFORMATION; NORMAL DISTRIBUTION; SOFTWARE; SPECTROPHOTOMETRY, INFRARED; SPECTROSCOPY, FOURIER TRANSFORM INFRARED; SULFURIC ACID ESTERS; TEMPERATURE; THERMODYNAMICS;

EID: 16244393036     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2004.10.050     Document Type: Article

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