Geometry & MOs

Info

ID:	4246
PubChem CID:	11034
Reduced:	NaSN2O5H9C12 (1)
Stoich.:	ABC2D5E9F12 (1)
Weight, g/mol:	316.012987
ΔH_f, kcal/mol:	-160.56
Dipole, Da:	6.55
IP(EA), eV:	-8.98(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;4-[(2,4-dihydroxyphenyl)diazenyl]benzenesulfonate

Drug info:

PubChemData

Smile

C1=CC(=CC=C1N=NC2=C(C=C(C=C2)O)O)S(=O)(=O)[O-].[Na+]

DOS

IR

Vibrations