休克尔方法

休克尔方法休克尔方法
  1. 应用推广休克尔方法研究环化GMP和环化UMP的构象,以及环化GMP的电子结构。

    The extended H ü ckel method was used to study the best conformation of cyclic GMP and cyclic UMP and the electronic structure of cyclic GMP .

  2. 分析6种判断化合物是否具有芳香性的规则即Dewar共振能、休克尔规则、汉斯的REPE指标、PMO判据、推广的休克尔规则及物理方法,并对各种判据的局限性和优点作了比较。

    Six major criteria of aromaticity , namely Dewar resonance energy , Huckel rule and Hess 's REPE index , PMO criterion , extended Huckel , rule and physical method , were introduced . The limitations and advantages of them were discussed in this paper .