IR, Raman and ab-initio calcualtions of 2,6-dimethoxyphenol  

C. Yohannan Panicker¹*, H.T. Varghese², K. Sajina¹, A.V. Vaidyan

¹Department of Physics, 4Department of Chemistry, TKM College of Arts and Science, Kollam (India).

²Department of Physics, Fatima Mata National College, Kollam (India).

³Department of Chemistry, St. Stephen’s College, Pathanapuram (India).

ABSTRACT:

IR and Raman spectra of 2,6-dimethoxyphenol were recorded and analyzed. The vibrational waves of the compound have been computed using the Hartree-Fock/6-31G* basis and compared with the experimental values. Predicted infrared intensities and Raman activities are reported.

KEYWORDS:

Hartree-Fock ab initio calculations; Raman; IR; methoxy

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Copy the following to cite this article: Panicker C. Y, Varghese H. T, K. Sajina K, Vaidyan A. V. IR, Raman and ab-initio calcualtions of 2,6-dimethoxyphenol. Orient J Chem 2008;24(3).

Copy the following to cite this URL: Panicker C. Y, Varghese H. T, K. Sajina K, Vaidyan A. V. IR, Raman and ab-initio calcualtions of 2,6-dimethoxyphenol. Orient J Chem 2008;24(3). Available from: http://www.orientjchem.org/?p=24999