Geometry & MOs

Info

ID:	284719
PubChem CID:	104064190
Reduced:	OCl2N3H13C15 (1)
Stoich.:	AB2C3D13E15 (1)
Weight, g/mol:	295.007931
ΔH_f, kcal/mol:	1.6
Dipole, Da:	2.9
IP(EA), eV:	-8.51(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C1=NC2=C(C=C(C=C2N1)Cl)N)OC3=CC(=CC=C3)Cl

DOS

IR

Vibrations