Spectroscopic Behavior, FMO, NBO Analysis of Pethidine and Diclofenac Drugs by Theoretical Approach
1. Spectroscopic Behavior, FMO, NBO Analysis of Pethidine and Diclofenac Drugs by Theoretical Approach

Mostafa Khajehzadeh; Sedigheh Rahmaniasl

Articles in Press, Accepted Manuscript, Available Online from 04 December 2019

http://dx.doi.org/10.33945/SAMI/AJCA.2020.4.3

Abstract
  In this work, the complete structural, vibrational, electronic, and spectroscopic properties (1H, 13C NMR, UV–vis) and, natural bond orbital (NBO), Frontier molecular orbital ...  Read More
The prediction and theoretical study for chemical reactivity, thermophysical and biological activity of morpholinium nitrate and nitrite ionic liquid crystals: A DFT study
2. The prediction and theoretical study for chemical reactivity, thermophysical and biological activity of morpholinium nitrate and nitrite ionic liquid crystals: A DFT study

Mohammad Jahidul Islam; Ajoy Kumer; Nuruzzaman Sarker; Sunanda Paul; Afroza Zannat

Volume 2, Issue 4 , Summer 2019, , Pages 316-326

http://dx.doi.org/10.33945/SAMI/AJCA.2019.4.5

Abstract
  As the morpholine and morphine have been used all over the world as pain killer drugs even used in cancer treatment, so the morpholine is more demanding chemical molecule. In our work, ...  Read More