Geometry & MOs

Info

ID:	284721
PubChem CID:	104064238
Reduced:	ClN4H13C14 (1)
Stoich.:	AB4C13D14 (1)
Weight, g/mol:	291.033003
ΔH_f, kcal/mol:	54.39
Dipole, Da:	4.88
IP(EA), eV:	-8.2(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-2-(2-chloro-3-methylphenyl)-1H-benzimidazol-4-amine

Drug info:

PubChemData

Smile

C1=CC=NC(=C1)CCC2=NC3=C(C=C(C=C3N2)Cl)N

DOS

IR

Vibrations