Geometry & MOs

Info

ID:	246694
PubChem CID:	103064647
Reduced:	N3S3O4C8H11 (1)
Stoich.:	A3B3C4D8E11 (1)
Weight, g/mol:	317.050398
ΔH_f, kcal/mol:	-66.44
Dipole, Da:	6.87
IP(EA), eV:	-8.66(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(methylamino)-4-nitro-N-(thiolan-3-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

C1CSCC1NS(=O)(=O)C2=CC(=C(S2)N)[N+](=O)[O-]

DOS

IR

Vibrations