期刊名称：Asian Journal of Biological and Life Sciences
印刷版ISSN：2278-747X
电子版ISSN：2278-5957
出版年度：2017
卷号：6
页码：380-384
出版社：Pbspublishing
摘要：In this work, we perform a set of quantum mechanical calculations on compounds bromoxynil and Dichlobenil. Various properties bond length, dipole moment, energy, HOMO-LUMO energy gap studied by using DFT method in Gaussian calculations. The stability and chemical reactivity have been studied.
