Determination of the Conjugacy Classes and Character Table of the Full Non-Rigid Group of Hexachlorocyclopropane Chemical Compound Via Wreath Product of Pair of Permutation Groups

Ben O. J., Auta T. J.
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Abstract

The use of full non-rigid (f.NRG) molecules group theory to study the internal dynamics of molecular structures of chemical compounds is trending in the research space. In this paper, we use computational method to compute the group elements and group table of the Hexachlorocyclopropane molecular (algebraic) structure and thereafter determine the order and conjugacy classes of the group and finally the corresponding symmetry for each permutation group. We considered the point group of the compound which turns out to be isomorphic to the Wreath Products C3wrC2, where Cn denotes a cyclic group of order n. We found that the group has order 18 and 9 conjugacy classes. Investigating the solubility of the components of Hexachlorocyclopropane chemical compound can be considered for further study.
通过对换群的花环积确定六氯环丙烷化合物全非刚性群的共轭类和特性表
利用全非刚性(f.NRG)分子群理论研究化合物分子结构的内部动力学是研究领域的发展趋势。在本文中,我们利用计算方法计算了六氯环丙烷分子(代数)结构的群元和群表,然后确定了群的阶数和共轭类,最后确定了每个置换群的相应对称性。我们考虑了该化合物的点群,发现它与花环产品 C3wrC2 同构,其中 Cn 表示阶数为 n 的循环群。可以考虑进一步研究六氯环丙烷化合物各组分的溶解性。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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