Geometry & MOs

Info

ID:	246683
PubChem CID:	103064613
Reduced:	S2N3O4C10H13 (1)
Stoich.:	A2B3C4D10E13 (1)
Weight, g/mol:	303.034748
ΔH_f, kcal/mol:	-62.26
Dipole, Da:	8.77
IP(EA), eV:	-8.55(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-2-nitro-N-(thiolan-3-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations