Vibrational spectroscopic studies and ab initio calculations of 2-cyanophenylisocyanid dichloride |
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| Authors: | Varghese Hema Tresa Panicker C Yohannan Philip Daizy Pazdera Pavel |
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| Affiliation: | Department of Physics, Fatima Mata National College, Kollam 691 001, Kerala, India. h_varghese@rediffmail.com |
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| Abstract: | FT-Raman and FT-IR spectra of 2-cyanophenylisocyanid dichloride were recorded and analyzed. The vibrational frequencies of the title compound have been computed using the Hartree-Fock/6-31G* basis and compared with the experimental values. The prepared compound was identified by NMR and mass spectra. |
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