Geometry & MOs

Info

ID:	10674
PubChem CID:	106545
Reduced:	S2N3O8H17C18 (1)
Stoich.:	A2B3C8D17E18 (1)
Weight, g/mol:	467.045707
ΔH_f, kcal/mol:	-219.93
Dipole, Da:	7.65
IP(EA), eV:	-8.7(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-amino-5-methoxy-2-methylphenyl)diazenyl]-5-hydroxynaphthalene-2,7-disulfonic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1N=NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3O)S(=O)(=O)O)OC)N

DOS

IR

Vibrations