Geometry & MOs

Info

ID:	6611
PubChem CID:	69227
Reduced:	SN2O5C6H6 (1)
Stoich.:	AB2C5D6E6 (1)
Weight, g/mol:	217.999742
ΔH_f, kcal/mol:	-114.02
Dipole, Da:	6.43
IP(EA), eV:	-10.14(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-3-nitrobenzenesulfonic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1S(=O)(=O)O)[N+](=O)[O-])N

DOS

IR

Vibrations