Geometry & MOs

Info

ID:	323937
PubChem CID:	126676641
Reduced:	N8H20C23 (1)
Stoich.:	A8B20C23 (1)
Weight, g/mol:	392.174945
ΔH_f, kcal/mol:	137.84
Dipole, Da:	4.51
IP(EA), eV:	-8.36(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(2-methylpyridin-4-yl)amino]phenyl]-N-pyridin-2-yl-3H-benzimidazol-5-amine

Drug info:

PubChemData

Smile

CC1=NC=CC(=C1)NC2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)NC5=NC(=NC=C5)N

DOS

IR

Vibrations