Geometry & MOs

Info

ID:	10994
PubChem CID:	109775
Reduced:	NaSN4O4H21C25 (1)
Stoich.:	ABC4D4E21F25 (1)
Weight, g/mol:	496.118121
ΔH_f, kcal/mol:	53.98
Dipole, Da:	46.88
IP(EA), eV:	-7.73(-2.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;3-[[3-[(4-ethoxy-3-methylphenyl)diazenyl]naphthalen-1-yl]diazenyl]benzenesulfonate

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)N=NC2=CC3=CC=CC=C3C(=C2)N=NC4=CC(=CC=C4)S(=O)(=O)[O-])C.[Na+]

DOS

IR

Vibrations