Keywords = B3LYP/6-31G (d, p) and ESP
Modeling The Effect of Functional Groups on The Electronic Properties of Benzene; Pyridine and Pyrimidine

Volume 62, The First International Conference on Molecular Modeling and Spectroscopy 19-22 February, 2019, July 2019, Pages 1-11

10.21608/ejchem.2019.12903.1807

Shimaa G. El Gabaly; Gehan M. Youssif; Ahmed M. Bayoumy; Hend Ezzat; Hanan Elhaes; Ahmed Refaat; Medhat Ibrahim