Comparative Theoretical Study of Stability, Lypophilicity, Dipole Moments, Acidity and Spectroscopic Properties of Non-Steroidal Anti-Inflammatory Drugs: Ibuprofen, Ketoprofen and Flurbiprofen
Assoma Amon Benjamine, Atse Adepo Jacques, Kone Soleymane & Bamba El Hadji Sawaliho · Chemical Science International Journal · 2020
A comparative theoretical study of some physicochemical properties of R and S enantiomers of ibuprofen, ketoprofen and flurbiprofen is undertaken in order to understand their reactivity. To do this, DFT and TD-DFT methods at the B3LYP/6-311G(d,p) level theory are used. The partit...
Open access
Research Article
10.9734/CSJI/2020/v29i530180