Geometry & MOs

Info

ID:	15097
PubChem CID:	429399
Reduced:	SO2C12H12 (1)
Stoich.:	AB2C12D12 (1)
Weight, g/mol:	220.055801
ΔH_f, kcal/mol:	-7.65
Dipole, Da:	5.75
IP(EA), eV:	-9.67(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4lambda6-thiatetracyclo[5.4.2.02,6.08,11]trideca-2(6),9,12-triene 4,4-dioxide

Drug info:

PubChemData

Smile

C1C2=C(CS1(=O)=O)C3C=CC2C4C3C=C4

DOS

IR

Vibrations