Geometry & MOs

Info

ID:	72157
PubChem CID:	48415873
Reduced:	ClON3C18H18 (1)
Stoich.:	ABC3D18E18 (1)
Weight, g/mol:	294.148061
ΔH_f, kcal/mol:	13.9
Dipole, Da:	1.7
IP(EA), eV:	-8.97(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N-methylpyridine-2-carboxamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3=CC=CC=C3Cl

DOS

IR

Vibrations