Karol Filipkowski, and Jan Fulara, and John P. Maier, . (2015) Electronic absorption spectra of linear C6Br and C6Br+ in neon matrices. Journal of molecular spectroscopy, Vol. 311 , special issue. pp. 64-68.
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Official URL: http://edoc.unibas.ch/dok/A6381770
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Abstract
Electronic absorption spectra of linear C6Br+ and C6Br have been recorded in 6 K neon matrices. Two strong absorption systems starting at 555.1 nm and 539.3 nm are assigned to the 1 2Π ← X 2Π electronic transition of C6Br, and 1 3Σ− ← X 3Σ− of C6Br+. Excitation of normal modes along with overtones and combination bands in the excited electronic state are observed. Assignments are based on mass-selection, photobleaching behavior, comparison with the known electronic transitions of linear C6Cl and C6Cl+, and excitation energies obtained with CASPT2 and SAC-CI theory as well as on computed vibrational frequencies.
Faculties and Departments: | 05 Faculty of Science > Departement Chemie > Former Organization Units Chemistry > Physikalische Chemie (Maier) |
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UniBasel Contributors: | Maier, John Paul and Filipkowski, Karol and Fulara, Jan |
Item Type: | Article, refereed |
Article Subtype: | Research Article |
Publisher: | Academic Press |
ISSN: | 0022-2852 |
Note: | Publication type according to Uni Basel Research Database: Journal article |
Identification Number: | |
Last Modified: | 05 Jun 2015 08:53 |
Deposited On: | 05 Jun 2015 08:53 |
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