Geometry & MOs

Info

ID:	9921
PubChem CID:	94807
Reduced:	NSO3C6H6 (2)
Stoich.:	ABC3D6E6 (2)
Weight, g/mol:	344.013678
ΔH_f, kcal/mol:	-218.97
Dipole, Da:	2.2
IP(EA), eV:	-8.78(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-5-(4-amino-3-sulfophenyl)benzenesulfonic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C2=CC(=C(C=C2)N)S(=O)(=O)O)S(=O)(=O)O)N

DOS

IR

Vibrations