Geometry & MOs

Info

ID:	5697
PubChem CID:	13507
Reduced:	N2S3O10H14C20 (1)
Stoich.:	A2B3C10D14E20 (1)
Weight, g/mol:	537.981058
ΔH_f, kcal/mol:	-284.63
Dipole, Da:	6.15
IP(EA), eV:	-9.34(-2.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-4-[(4-sulfonaphthalen-1-yl)diazenyl]naphthalene-2,7-disulfonic acid

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)O)N=NC3=C4C=CC(=CC4=CC(=C3O)S(=O)(=O)O)S(=O)(=O)O

DOS

IR

Vibrations