Geometry & MOs

Info

ID:	4459
PubChem CID:	11436
Reduced:	NaN3O5H8C13 (1)
Stoich.:	AB3C5D8E13 (1)
Weight, g/mol:	309.036165
ΔH_f, kcal/mol:	-86.27
Dipole, Da:	14.3
IP(EA), eV:	-8.69(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;2-hydroxy-5-[(3-nitrophenyl)diazenyl]benzoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations