Geometry & MOs

Info

ID:	158146
PubChem CID:	56463061
Reduced:	ClSN3O3C19H20 (1)
Stoich.:	ABC3D3E19F20 (1)
Weight, g/mol:	445.130757
ΔH_f, kcal/mol:	-64.61
Dipole, Da:	5.43
IP(EA), eV:	-8.38(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,3-benzodioxol-5-yl)-N-methyl-5-oxo-N-[1-(3-sulfamoylphenyl)ethyl]pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC(=CC=C1)S(=O)(=O)N)N(C)C(=O)C2=C(C3=CC=CC=C3N2C)Cl

DOS

IR

Vibrations