Vibronic spectra, ab initio calculations, and structures of conformationally non-rigid molecules of oxalyl halides in the ground and lowest excited electronic states - Part VI: Oxalyl bromide (COBr)2 and summary

Article ID	Journal	Published Year	Pages	File Type
5415093	Journal of Molecular Spectroscopy	2011	10 Pages	PDF

Abstract

âº Ab initio study of (COBr)2 structure in the ground and excited electronic states. âº Reanalysis of experimental vibronic spectra of (COBr)2. âº Reassignments of vibronic bands based on calculated data and vibrational spectra. âº Overview of oxalyl halides structural data.

Keywords

Vibronic spectra Internal rotation

Related Topics

Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry

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Vibronic spectra, ab initio calculations, and structures of conformationally non-rigid molecules of oxalyl halides in the ground and lowest excited electronic states - Part VI: Oxalyl bromide (COBr)2 and summary

Authors

I.A. Godunov, S.I. Bokarev, D.V. Maslov, N.N. Yakovlev,