Geometry & MOs

Info

ID:	21123
PubChem CID:	587292
Reduced:	ClON2H15C21 (1)
Stoich.:	ABC2D15E21 (1)
Weight, g/mol:	346.087291
ΔH_f, kcal/mol:	51.22
Dipole, Da:	4.82
IP(EA), eV:	-9.25(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-benzylbenzimidazol-1-yl)-(2-chlorophenyl)methanone

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC2=NC3=CC=CC=C3N2C(=O)C4=CC=CC=C4Cl

DOS

IR

Vibrations