Geometry & MOs

Info

ID:	13665
PubChem CID:	396596
Reduced:	N6H12C13 (1)
Stoich.:	A6B12C13 (1)
Weight, g/mol:	252.112344
ΔH_f, kcal/mol:	125.27
Dipole, Da:	2.02
IP(EA), eV:	-8.74(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-pyrimidin-4-ylethylideneamino)-1H-benzimidazol-2-amine

Drug info:

PubChemData

Smile

CC(=NNC1=NC2=CC=CC=C2N1)C3=NC=NC=C3

DOS

IR

Vibrations