Theoretical Study of the Chemical Reactivity of a Series of 2, 3-Dihydro-1H-Perimidine
Nanou Tieba Tuo, Georges Stephane Dembele, Soro Doh, Fandia Konate, Bibata Konate, Charles Guillaume Kodjo & Nahossé Ziao · International Research Journal of Pure and Applied Chemistry · 2022
This reactivity study was performed on seven molecules of a 2,3-dihydro-1H-perimidine series using density functional theory at the B3LYP / 6-311 G (d, p) level. Calculation of the dipole moment showed that compound 4 is more soluble in aqueous medium. The study of frontier molec...