Geometry & MOs

Info

ID:	20932
PubChem CID:	586320
Reduced:	SO2H8C9 (2)
Stoich.:	AB2C8D9 (2)
Weight, g/mol:	360.049001
ΔH_f, kcal/mol:	-66.53
Dipole, Da:	9.6
IP(EA), eV:	-10.12(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10,11-dimethyl-9lambda6,12lambda6-dithiapentacyclo[9.7.0.02,10.03,8.013,18]octadeca-3,5,7,13,15,17-hexaene 9,9,12,12-tetraoxide

Drug info:

PubChemData

Smile

CC12C(C3C1(S(=O)(=O)C4=CC=CC=C34)C)C5=CC=CC=C5S2(=O)=O

DOS

IR

Vibrations