Geometry & MOs

Info

ID:

8702

PubChem CID:

80422

Reduced:

Na2S2N5O7H21C32 (1)

Stoich.:

A2B2C5D7E21F32 (1)

Weight, g/mol:

697.067779

ΔHf, kcal/mol:

-145.78

Dipole, Da:

63.67

IP(EA), eV:

 -7.74(-2.76)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

disodium;5-[[4-[(4-anilino-3-sulfonatophenyl)diazenyl]naphthalen-1-yl]diazenyl]-6-hydroxynaphthalene-2-sulfonate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC2=C(C=C(C=C2)N=NC3=CC=C(C4=CC=CC=C43)N=NC5=C(C=CC6=C5C=CC(=C6)S(=O)(=O)[O-])O)S(=O)(=O)[O-].[Na+].[Na+]

DOS

IR

Vibrations