Geometry & MOs

Info

ID:	246676
PubChem CID:	103064596
Reduced:	O2S2N3C10H15 (1)
Stoich.:	A2B2C3D10E15 (1)
Weight, g/mol:	317.050398
ΔH_f, kcal/mol:	-58.55
Dipole, Da:	5.12
IP(EA), eV:	-8.57(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-2-methyl-5-nitro-N-(thiolan-3-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

CNC1=C(C=CC=N1)S(=O)(=O)NC2CCSC2

DOS

IR

Vibrations