Geometry & MOs

Info

ID:

11032

PubChem CID:

110141

Reduced:

N3S4O14H21C24 (1)

Stoich.:

A3B4C14D21E24 (1)

Weight, g/mol:

702.990637

ΔHf, kcal/mol:

-460.52

Dipole, Da:

8.25

IP(EA), eV:

 -9.02(-2.15)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-acetamido-4-hydroxy-3-[[1-sulfo-6-(2-sulfooxyethylsulfonyl)naphthalen-2-yl]diazenyl]naphthalene-2-sulfonic acid

Drug info:

PubChemData

Smile

CC(=O)NC1=CC2=CC(=C(C(=C2C=C1)O)N=NC3=C(C4=C(C=C3)C=C(C=C4)S(=O)(=O)CCOS(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

DOS

IR

Vibrations