Geometry & MOs

Info

ID:	54310
PubChem CID:	16977904
Reduced:	ClON3C21H24 (1)
Stoich.:	ABC3D21E24 (1)
Weight, g/mol:	467.270341
ΔH_f, kcal/mol:	-6.5
Dipole, Da:	4.38
IP(EA), eV:	-8.96(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-[2-(1-dodecylbenzimidazol-2-yl)ethyl]benzamide

Drug info:

PubChemData

Smile

CCCCCN1C2=CC=CC=C2N=C1CCNC(=O)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations