Geometry & MOs

Info

ID:	72023
PubChem CID:	48415726
Reduced:	ClO2N3C19H20 (1)
Stoich.:	AB2C3D19E20 (1)
Weight, g/mol:	337.179027
ΔH_f, kcal/mol:	-23.29
Dipole, Da:	5.57
IP(EA), eV:	-8.88(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)COC3=CC=CC=C3Cl

DOS

IR

Vibrations