Geometry & MOs

Info

ID:	10530
PubChem CID:	103832
Reduced:	Na2N3S3O8H19C20 (1)
Stoich.:	A2B3C3D8E19F20 (1)
Weight, g/mol:	571.012967
ΔH_f, kcal/mol:	-366.57
Dipole, Da:	8.87
IP(EA), eV:	-8.96(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

disodium;1-phenyl-3-[4-(pyridin-2-ylsulfamoyl)anilino]propane-1,3-disulfonate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(CC(NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

DOS

IR

Vibrations