Geometry & MOs

Info

ID:	16440
PubChem CID:	469137
Reduced:	NCl2H4C7 (2)
Stoich.:	AB2C4D7 (2)
Weight, g/mol:	345.941209
ΔH_f, kcal/mol:	47.35
Dipole, Da:	4.53
IP(EA), eV:	-9.3(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5,6-trichloro-1-[(4-chlorophenyl)methyl]benzimidazole

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CN2C3=CC(=C(C=C3N=C2Cl)Cl)Cl)Cl

DOS

IR

Vibrations