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Vibrations of the S1 state of fluorobenzene-h5 and fluorobenzene-d5 via resonance-enhanced multiphoton ionization (REMPI) spectroscopy.

Authors :
Harris JP
Andrejeva A
Tuttle WD
Pugliesi I
Schriever C
Wright TG
Source :
The Journal of chemical physics [J Chem Phys] 2014 Dec 28; Vol. 141 (24), pp. 244315.
Publication Year :
2014

Abstract

We report resonance-enhanced multiphoton ionization spectra of the isotopologues fluorobenzene-h5 and fluorobenzene-d5. By making use of quantum chemical calculations, the changes in the wavenumber of the vibrational modes upon deuteration are examined. Additionally, the mixing of vibrational modes both between isotopologues and also between the two electronic states is discussed. The isotopic shifts lead to dramatic changes in the appearance of the spectrum as vibrations shift in and out of Fermi resonance. Assignments of the majority of the fluorobenzene-d5 observed bands are provided, aided by previous results on fluorobenzene-h5.

Details

Language :
English
ISSN :
1089-7690
Volume :
141
Issue :
24
Database :
MEDLINE
Journal :
The Journal of chemical physics
Publication Type :
Academic Journal
Accession number :
25554159
Full Text :
https://doi.org/10.1063/1.4904706