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

The preferred conformations of dimethyl sulfate and their vibrational spectra were studied by matrix-isolation FT-IR spectroscopy and theoretical methods (DFT and MP2, with basis sets of different sizes, including the quadruple-zeta, aug-cc-pVQZ basis). Conformer GG (of C2 symmetry and exhibiting OS...

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Bibliographic Details
Main Author: Borba, Ana (author)
Other Authors: Gómez-Zavaglia, Andrea (author), Simões, Pedro N. N. L. (author), Fausto, Rui (author)
Format: article
Language:eng
Published: 2005
Subjects:
Online Access:http://hdl.handle.net/10316/5103
Country:Portugal
Oai:oai:estudogeral.sib.uc.pt:10316/5103