Geometry & MOs

Info

ID:	62730
PubChem CID:	26736390
Reduced:	N3O4C19H19 (1)
Stoich.:	A3B4C19D19 (1)
Weight, g/mol:	472.214427
ΔH_f, kcal/mol:	-112.76
Dipole, Da:	8.96
IP(EA), eV:	-8.66(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]-N-(2-ethoxyphenyl)propanamide

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3OCC)NC(=O)C1=O

DOS

IR

Vibrations