Geometry & MOs

Info

ID:	72178
PubChem CID:	48415894
Reduced:	O2N3H21C22 (1)
Stoich.:	A2B3C21D22 (1)
Weight, g/mol:	344.163711
ΔH_f, kcal/mol:	-5.89
Dipole, Da:	5.0
IP(EA), eV:	-8.87(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3=CC4=CC=CC=C4C=C3O

DOS

IR

Vibrations