Geometry & MOs

Info

ID:	65129
PubChem CID:	29204507
Reduced:	SN2O4C19H24 (1)
Stoich.:	AB2C4D19E24 (1)
Weight, g/mol:	490.134462
ΔH_f, kcal/mol:	-131.99
Dipole, Da:	8.52
IP(EA), eV:	-8.96(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[3-(diethylsulfamoyl)phenyl]-1-(1,1-dioxo-1,2-benzothiazol-3-yl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)NC(=O)C2=C(C=CC(=C2)C)OC

DOS

IR

Vibrations