Pharmaceutica Analytica Acta

Srinivasaraghavan R

Publications

• Research Article
  Experimental and Theoretical Spectroscopic Analysis on N-((1-(phenylsulfonyl)- 1H-indol-3-Yl)methyl)acetamide
  Author(s): Srinivasaraghavan R, Seshadri S, Gnanasambandan T and Srinivasan G Srinivasaraghavan R, Seshadri S, Gnanasambandan T and Srinivasan G
  
  In this work, The structural characteristics and vibrational spectroscopic analysis were carried out by quantum chemical methods with the hybrid exchange-correlation functional B3LYP using 6-31G (d, p) and 6-311++G (d, p) basis sets in order to investigate the fundamental modes of vibrational analysis and electronic properties of phenyl substituted compound N-((1-(phenylsulfonyl)-1H-indol-3-yl)methyl)acetamide. Density Functional Theory (DFT) method, using B3LYP functional, with 6-31G (d, p) and 6-311++G (d, p) basis sets, which in turn creates a platform to study the structure of the chosen compound. The experimentally obtained FTIR and FT Raman spectrum supports the results of theoretically observed ones. Detailed interpretations of the experimental spectra of the molecule along with the theoretical ones are reported based on Potential Energy Distribution (PED). The total .. View More»
  DOI: 10.4172/2153-2435.S8-002

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