Geometry & MOs

Info

ID:

11014

PubChem CID:

109833

Reduced:

NaSN5O5C30H30 (1)

Stoich.:

ABC5D5E30F30 (1)

Weight, g/mol:

595.186535

ΔHf, kcal/mol:

-59.55

Dipole, Da:

8.65

IP(EA), eV:

 -7.78(-0.69)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

sodium;4-[[N-ethyl-4-[[2-methoxy-4-[(2-methoxyphenyl)diazenyl]-5-methylphenyl]diazenyl]anilino]methyl]benzenesulfonate

Drug info:

PubChemData

Smile

CCN(CC1=CC=C(C=C1)S(=O)(=O)[O-])C2=CC=C(C=C2)N=NC3=C(C=C(C(=C3)C)N=NC4=CC=CC=C4OC)OC.[Na+]

DOS

IR

Vibrations