Molecular structure, vibrational spectra, UV–vis, NBO, and NMR analyses on nevirapine using ab initio DFT methods

Subject Areas : Journal of Theoretical and Applied Physics

Shanmugam Srinivasan ¹ (PG and Research Department of Physics, Presidency College)
Julie Charles ² (Department of Physics, SSN College of Engineering)
Jayaprakash Ramesh ³ (Department of Pharmaceutical Analysis, JKK Munirajah Medical Research Foundation College of Pharmacy)
Govindaswamy Ranganathan Ramkumaar ⁴ (PG AND Research Department of Physics, Pachaiyappa 's College)
Thirumazhisai Jambulingam Bhoopathy ⁵ (PG and Research Department of Physics, Pachaiyappa' s College)
Sethu Gunasekaran ⁶ (PG AND Research Department of Physics, Pachaiyappa 's College)

Published : 2013-12-01

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