Geometry & MOs

Info

ID:	21668
PubChem CID:	589471
Reduced:	S2Cl4O4H8C13 (1)
Stoich.:	A2B4C4D8E13 (1)
Weight, g/mol:	433.858862
ΔH_f, kcal/mol:	-131.06
Dipole, Da:	5.49
IP(EA), eV:	-9.54(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,4-dichloro-2-[(2,5-dichlorophenyl)sulfonylmethylsulfonyl]benzene

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)S(=O)(=O)CS(=O)(=O)C2=C(C=CC(=C2)Cl)Cl)Cl

DOS

IR

Vibrations