Geometry & MOs

Info

ID:	9512
PubChem CID:	90464
Reduced:	SN2O5C6H6 (1)
Stoich.:	AB2C5D6E6 (1)
Weight, g/mol:	217.999742
ΔH_f, kcal/mol:	-110.26
Dipole, Da:	2.47
IP(EA), eV:	-9.76(-1.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-4-nitrobenzenesulfonic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1[N+](=O)[O-])N)S(=O)(=O)O

DOS

IR

Vibrations