Geometry & MOs

Info

ID:	72204
PubChem CID:	48415921
Reduced:	O2N4C21H28 (1)
Stoich.:	A2B4C21D28 (1)
Weight, g/mol:	362.174276
ΔH_f, kcal/mol:	-43.77
Dipole, Da:	8.52
IP(EA), eV:	-9.02(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-2-(4-cyanophenoxy)-N-methylpropanamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3CCN(CC3)C(=O)C4CC4

DOS

IR

Vibrations