We report vibrationally resolved spectra of the S1←S0 transition of chlorobenzene using resonance-enhanced multiphoton ionization spectroscopy. We study chlorobenzene-h5 as well as its perdeuterated isotopologue, chlorobenzene-d5. Changes in the form of the vibrational modes between the isotopologues and also between the S0 and S1 electronic states are discussed for each species. Vibrational bands are assigned utilizing quantum chemical calculations, previous experimental results, and isotopic shifts, including those between the 35Cl and 37Cl isotopologues. Previous work and assignments of the S1 spectra are discussed. Additionally, the vibrations in the ground state cation, D, are considered, since these have also been used by previous workers in assigning the excited neutral state spectra.
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14 September 2015
Research Article|
September 11 2015
Assignment of the vibrations of the S, S1, and D states of perhydrogenated and perdeuterated isotopologues of chlorobenzene
Anna Andrejeva;
Anna Andrejeva
School of Chemistry,
University of Nottingham
, University Park, Nottingham NG7 2RD, United Kingdom
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William D. Tuttle;
William D. Tuttle
School of Chemistry,
University of Nottingham
, University Park, Nottingham NG7 2RD, United Kingdom
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Joe P. Harris;
Joe P. Harris
School of Chemistry,
University of Nottingham
, University Park, Nottingham NG7 2RD, United Kingdom
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Timothy G. Wright
Timothy G. Wright
a)
School of Chemistry,
University of Nottingham
, University Park, Nottingham NG7 2RD, United Kingdom
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a)
Author to whom correspondence should be addressed. Electronic mail: [email protected]
J. Chem. Phys. 143, 104312 (2015)
Article history
Received:
July 01 2015
Accepted:
August 21 2015
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Citation
Anna Andrejeva, William D. Tuttle, Joe P. Harris, Timothy G. Wright; Assignment of the vibrations of the S, S1, and D states of perhydrogenated and perdeuterated isotopologues of chlorobenzene. J. Chem. Phys. 14 September 2015; 143 (10): 104312. https://doi.org/10.1063/1.4929996
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