Geometry & MOs

Info

ID:	71975
PubChem CID:	48415675
Reduced:	SO2N4C20H24 (1)
Stoich.:	AB2C4D20E24 (1)
Weight, g/mol:	321.184112
ΔH_f, kcal/mol:	-31.73
Dipole, Da:	8.26
IP(EA), eV:	-8.71(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)CCCNC(=O)C3=CC=CS3

DOS

IR

Vibrations