Geometry & MOs

Info

ID:	72194
PubChem CID:	48415911
Reduced:	O3N5C22H25 (1)
Stoich.:	A3B5C22D25 (1)
Weight, g/mol:	293.152812
ΔH_f, kcal/mol:	11.93
Dipole, Da:	6.68
IP(EA), eV:	-8.94(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

DOS

IR

Vibrations