| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 1233331 | Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy | 2011 | 12 Pages |
Abstract
⺠The FT-IR and FT-Raman spectra of 1-bromo-3-fluorobenzene molecule have been recorded. ⺠The vibrational frequencies in the ground state are evaluated using DFT method. ⺠In this method, the 6-31++G(d,p) and 6-311++G(d,p) basis sets are used. ⺠The complete data of this title compound provide some useful information for the study of substituted benzenes. ⺠The influence of bromine and fluorine atom on the geometry of benzene and its normal modes of vibrations has also been discussed.
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Authors
D. Mahadevan, S. Periandy, M. Karabacak, S. Ramalingam,