Geometry & MOs

Info

ID:	71913
PubChem CID:	48415611
Reduced:	ON5C21H21 (1)
Stoich.:	AB5C21D21 (1)
Weight, g/mol:	400.156912
ΔH_f, kcal/mol:	60.97
Dipole, Da:	6.5
IP(EA), eV:	-8.9(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N-methyl-3-(4-sulfamoylphenyl)propanamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3=CN=CN3C4=CC=CC=C4

DOS

IR

Vibrations