Geometry & MOs

Info

ID:	131190
PubChem CID:	51172247
Reduced:	ClSO3N4C17H21 (1)
Stoich.:	ABC3D4E17F21 (1)
Weight, g/mol:	393.118084
ΔH_f, kcal/mol:	-58.28
Dipole, Da:	3.04
IP(EA), eV:	-8.89(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(dimethylsulfamoyl)phenyl]-2-(2-thiophen-2-ylpyrrolidin-1-yl)acetamide

Drug info:

PubChemData

Smile

CS(=O)(=O)CCN1CCN(CC1)C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl

DOS

IR

Vibrations