Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

[2E2-20] HF and DFT Analysis of 2-Methoxypyridylchalcogen Compounds: A Combined Experimental and Theoretical Analysis

01.Oral A

○SINGH, Avtar; SINGH, Jaspreet; SHARMA, Neha (Dept. Chem., Sri Guru Teg Bahadur Khalsa College)

PC Setting Time : 11:10 - 11:20

Keywords:organochalcogen、Hartree Fock、Density functional theoretical、HOMO、LUMO