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Spectroscoic Investigations of 2-Hydroxy-4-methyl Pyrimidine Hydrochloride

C. Yohannan Panicker, Hema Tresa Varghese, P. E. Eapen, K. Raju, Subarna Ganguli, Fathima Beegum and Y. Sheena Mary


The vibrational frequencies of 2-hydroxy-4-methyl pyrimidine were calculated using Gaussian 03 software package and the fundamental modes are assigned. The calculated frequencies are in agreement with the reported experimental values. The calculated geometrical parameters are compared with the geometrical parameters of similar derivatives. The calculated first hyperpolarizability is comparable with the reported values of similar derivatives and is an attractive object for future studies of non linear optics.


索引于

  • 中国社会科学院
  • 谷歌学术
  • 打开 J 门
  • 中国知网(CNKI)
  • 引用因子
  • 宇宙IF
  • 电子期刊图书馆
  • 研究期刊索引目录 (DRJI)
  • 秘密搜索引擎实验室
  • ICMJE

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