Experimental and Ab Initio Vibrational Spectra of 1,2-Dibromoethane, Meso-1,2-Dideuterio-1,2-Dibromoethane, and Chiral 1,2-Dideuterio-1,2-Dibromoethane

摘要

The vibrational spectra of 1,2-dibromoethane and the meso and chiral forms of 1,2-dideuterio-1,2-dibromoethane are presented. The experimental spectra were obtained for neat liquid samples as well as for the molecules isolated in low-temperature matrices. The ab initio calculations of the vibrational frequencies and intensities were carried out with different basis sets. Reprints. (AW)