
Theoretical study of poly(azolyl)borane radical anions
Keywords: پیره; DFT; density functional theory; NBO; natural bond orbital; LB; Lewis base; BDE; bond dissociation energy; az; azolyl; Pyrr; pyrrolyl; Indo; indolyl; Pyra; pyrazolyl; Imi; imidazolyl; Inda; indazolyl; Benimi; benzimidazolyl; tria124; 1,2,4-triazolyl; tria1