Geometry & MOs

Info

ID:

8692

PubChem CID:

80380

Reduced:

SN2O6H9C13 (2)

Stoich.:

AB2C6D9E13 (2)

Weight, g/mol:

642.036264

ΔHf, kcal/mol:

-308.58

Dipole, Da:

3.1

IP(EA), eV:

 -9.61(-2.0)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[[4-[4-[(3-carboxy-4-hydroxyphenyl)diazenyl]-2-sulfophenyl]-3-sulfophenyl]diazenyl]-2-hydroxybenzoic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1N=NC2=CC(=C(C=C2)O)C(=O)O)S(=O)(=O)O)C3=C(C=C(C=C3)N=NC4=CC(=C(C=C4)O)C(=O)O)S(=O)(=O)O

DOS

IR

Vibrations