Geometry & MOs

Info

ID:	72344
PubChem CID:	48416069
Reduced:	O3N4C23H26 (1)
Stoich.:	A3B4C23D26 (1)
Weight, g/mol:	351.194677
ΔH_f, kcal/mol:	-45.08
Dipole, Da:	5.73
IP(EA), eV:	-8.89(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)COC3=CC=CC(=C3)NC(=O)C4CC4

DOS

IR

Vibrations