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ferrozine(2-)

Go to external page http://purl.obolibrary.org/obo/CHEBI_63945

An organosulfonate oxoanion obtained by deprotonation of the sulfo groups of 4,4'-[3-(pyridin-2-yl)-1,2,4-triazine-5,6-diyl]dibenzenesulfonic acid.

Term info

Label

ferrozine(2-)

Synonyms
  • 4,4'-[3-(pyridin-2-yl)-1,2,4-triazine-5,6-diyl]dibenzenesulfonate
database cross reference
Subsets

3_STAR

IUPAC NAME
4,4'-[3-(pyridin-2-yl)-1,2,4-triazine-5,6-diyl]dibenzenesulfonate [ IUPAC ]

charge

-2

formula

C20H12N4O6S2

has obo namespace

chebi_ontology

has related synonym

ferrozine cation

id

CHEBI:63945

inchi

InChI=1S/C20H14N4O6S2/c25-31(26,27)15-8-4-13(5-9-15)18-19(14-6-10-16(11-7-14)32(28,29)30)23-24-20(22-18)17-3-1-2-12-21-17/h1-12H,(H,25,26,27)(H,28,29,30)/p-2

inchikey

JFVUMQYWYNDZDK-UHFFFAOYSA-L

mass

468.46200

monoisotopicmass

468.02092

smiles

[O-]S(=O)(=O)c1ccc(cc1)-c1nnc(nc1-c1ccc(cc1)S([O-])(=O)=O)-c1ccccn1