Geometry & MOs

Info

ID:	233099
PubChem CID:	87692410
Reduced:	O2C39H50 (1)
Stoich.:	A2B39C50 (1)
Weight, g/mol:	489.75387
ΔH_f, kcal/mol:	-84.44
Dipole, Da:	1.09
IP(EA), eV:	-8.36(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-diiodobenzene-1,4-disulfonic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C(C)(C)C)O)CC2=CC=CC=C2.CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC2=CC=CC=C2

DOS

IR

Vibrations