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Substance Name: EINECS 247-610-5
RN: 26321-58-4
InChIKey: HNHJZBONOOYFNP-ODHFMREASA-J

Molecular Formula

  • C32-H16-Cu2-N6-O16-S4.4H

Molecular Weight

  • 999.892
 
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Names and Synonyms

Results Name

  • EINECS 247-610-5

Synonym

  • EINECS 247-610-5

Systematic Name

  • Tetrahydrogen (mu-((3,3'-((3,3'-dihydroxy(1,1'-biphenyl)-4,4'-diyl)bis(azo))bis(5-amino-4-hydroxynaphthalene-2,7-disulphonato))(8-)))dicuprate(4-)

Registry Numbers

CAS Registry Number

  • 26321-58-4

System Generated Number

  • 0026321584

Molecular Formulas

Molecular Formula

  • C32-H16-Cu2-N6-O16-S4.4H

Molecular Formula Fragments

  • C32-H16-Cu2-N6-O16-S4
  • COMPONENT
  • H

Structure Descriptors

InChI

1S/C32H24N6O16S4.2Cu/c33-19-11-17(55(43,44)45)5-15-9-25(57(49,50)51)29(31(41)27(15)19)37-35-21-3-1-13(7-23(21)39)14-2-4-22(24(40)8-14)36-38-30-26(58(52,53)54)10-16-6-18(56(46,47)48)12-20(34)28(16)32(30)42;;/h1-12,39-42H,33-34H2,(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54);;/q;2*+2/p-4/b37-35-,38-36-;;

InChIKey

HNHJZBONOOYFNP-ODHFMREASA-J

Smiles

Nc1cc(cc2cc(c3N=Nc4ccc(cc4O[Cu]Oc3c12)c5ccc6N=Nc7c(O[Cu]Oc6c5)c8c(N)cc(cc8cc7S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-]