Geometry & MOs

Info

ID:	66006
PubChem CID:	46488097
Reduced:	ClON5H12C17 (1)
Stoich.:	ABC5D12E17 (1)
Weight, g/mol:	295.132077
ΔH_f, kcal/mol:	74.92
Dipole, Da:	4.22
IP(EA), eV:	-8.69(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1H-benzimidazol-2-yl)-3-propoxybenzamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)NC(=N2)NC(=O)C3=CN(N=C3)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations