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...

ver descrição completa

Detalhes bibliográficos
Autor principal: Borba, Ana (author)
Outros Autores: Gómez-Zavaglia, Andrea (author), Simões, Pedro N. N. L. (author), Fausto, Rui (author)
Formato: article
Idioma:eng
Publicado em: 2005
Assuntos:
Texto completo:http://hdl.handle.net/10316/5103
País:Portugal
Oai:oai:estudogeral.sib.uc.pt:10316/5103