Geometry & MOs

Info

ID:	19395
PubChem CID:	562887
Reduced:	S2O6C17H20 (1)
Stoich.:	A2B6C17D20 (1)
Weight, g/mol:	384.070131
ΔH_f, kcal/mol:	-216.05
Dipole, Da:	0.38
IP(EA), eV:	-8.9(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis(4-methylphenyl) propane-1,3-disulfonate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OS(=O)(=O)CCCS(=O)(=O)OC2=CC=C(C=C2)C

DOS

IR

Vibrations