Geometry & MOs

Info

ID:	71909
PubChem CID:	48415606
Reduced:	ClO2N4C20H21 (1)
Stoich.:	AB2C4D20E21 (1)
Weight, g/mol:	394.200491
ΔH_f, kcal/mol:	-29.79
Dipole, Da:	2.77
IP(EA), eV:	-9.01(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[3-(1H-benzimidazol-2-yl)propyl-methylamino]-2-oxoethyl]-2-ethoxybenzamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)CNC(=O)C3=CC=CC=C3Cl

DOS

IR

Vibrations