Conformational landscape of small organosilicon compounds from the combined use of gas electron diffraction, IR and Raman spectroscopies and quantum chemical calculations: diethyldichlorosilane

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Author
Montejo, Manuel
Wann, Derek A.
Rodríguez Ortega, Pilar Gema
Robertson, Heather E.
Márquez, Fernando
Rankin, David W. H.
López González, Juan Jesús
Publisher
WileyDate
2009Subject
DiethyldichlorosilaneGas-phase electron diffraction
IR spectra
Raman spectra
Density functional theory
Ab initio calculations
Scaled quantum-mechanical force field methodology
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Aconformational study of diethyldichlorosilane and the elucidation of the gas-phasemolecular structures of its four conformers have been performed using the combined approach of gas-phase electron diffraction and computational techniques.Moreover, the Raman spectrum of the liquid and the IR spectra of the gas and liquid phases have been recorded and thoroughly analyzed on the basis of the scaled quantum-mechanical force field methodology. The results of the vibrational assignment have given spectroscopic evidence of the presence of the different conformers in the samples.
