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Substance Name: Cobaltate(1-), bis(3-(2-(4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)diazenyl-kappaN1)-4-(hydroxy-kappaO)-N-(1-methylethyl)benzenesulfonamidato(2-))-, hydrogen, compd. with 2-propanamine (1:1:1)
RN: 71839-74-2
InChIKey: XBBLQPZIRZCMDF-XJQIYIKESA-M

Molecular Formula

  • C38-H38-Co-N10-O8-S2.C3-H9-N.H

Molecular Weight

  • 945.964
 
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Names and Synonyms

Synonym

  • EINECS 276-061-4

Systematic Names

  • Cobaltate(1-), bis(3-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-4-hydroxy-N-(1-methylethyl)benzenesulfonamidato(2-))-, hydrogen, compd. with 2-propanamine (1:1)
  • Cobaltate(1-), bis(3-(2-(4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)diazenyl-kappaN1)-4-(hydroxy-kappaO)-N-(1-methylethyl)benzenesulfonamidato(2-))-, hydrogen, compd. with 2-propanamine (1:1:1)
  • Hydrogen bis(3-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-4-hydroxy-N-isopropylbenzenesulphonamidato(2-))cobaltate(1-) , compound with isopropylamine (1:1)

Registry Numbers

CAS Registry Number

  • 71839-74-2

System Generated Number

  • 0071839742

Molecular Formulas

Molecular Formula

  • C38-H38-Co-N10-O8-S2.C3-H9-N.H

Molecular Formula Fragments

  • C3-H9-N
  • C38-H38-Co-N10-O8-S2
  • COMPONENT
  • H

Structure Descriptors

InChI

1S/2C19H20N5O4S.C3H9N.Co/c2*1-12(2)23-29(27,28)15-9-10-17(25)16(11-15)20-21-18-13(3)22-24(19(18)26)14-7-5-4-6-8-14;1-3(2)4;/h2*4-12,23,25H,1-3H3;3H,4H2,1-2H3;/q2*-1;;+3/p-1/b2*21-20+;;

InChIKey

XBBLQPZIRZCMDF-XJQIYIKESA-M

Smiles

S(=O)(=O)(c1cc(\N=N\[C@@-]2C(=NN(C2=O)c2ccccc2)C)c([O-])cc1)NC(C)C.[Co+3].NC(C)C.S(=O)(c1cc(c(cc1)[O-])\N=N\[C@@-]1C(=NN(C1=O)c1ccccc1)C)(NC(C)C)=O