Investigating the Effect of Fullerene on the Basicity of Paraphenylenediamine by using the Quantum Chemistry Methods

In this study, paraphenylenediamine was first bonded to the fullerene and was optimized geometrically by Using the quantum chemistry methods. paraphenylenediamine was examined in the isolated state and in the fullerene-bonded state via carbon atoms. In the theoretical research, the simulation was do...

Full description

Bibliographic Details
Main Author: S. Sepehr Uroomiye
Format: Article
Language:English
Published: Iranian Chemical Science and Technologies Association 2019-09-01
Series:International Journal of New Chemistry
Online Access:http://www.ijnc.ir/article_35130_21c1c1aa9e9fa04474208dc7f74f01e8.pdf