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Substance Name: Hydrogen (29H,31H-phthalocyaninesulphonato(3-)-N29,N30,N31,N32)cuprate(1-), compound with N,N'-di(o-tolyl)guanidine (1:1)
RN: 77097-86-0
InChIKey: LIEQWFQJAQZZAS-UHFFFAOYSA-N

Molecular Formula

  • C32-H15-Cu-N8-O3-S.C15-H17-N3.H

Molecular Weight

  • 895.4637
 
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Names and Synonyms

Synonym

  • EINECS 278-620-8

Systematic Name

  • Hydrogen (29H,31H-phthalocyaninesulphonato(3-)-N29,N30,N31,N32)cuprate(1-), compound with N,N'-di(o-tolyl)guanidine (1:1)

Registry Numbers

CAS Registry Number

  • 77097-86-0

System Generated Number

  • 0077097860

Molecular Formulas

Molecular Formula

  • C32-H15-Cu-N8-O3-S.C15-H17-N3.H

Molecular Formula Fragments

  • C15-H17-N3
  • C32-H15-Cu-N8-O3-S
  • COMPONENT
  • H

Structure Descriptors

InChI

1S/C32H16N8O3S.C15H17N3.Cu/c41-44(42,43)16-13-14-23-24(15-16)32-39-30-22-12-6-5-11-21(22)28(37-30)35-26-18-8-2-1-7-17(18)25(33-26)34-27-19-9-3-4-10-20(19)29(36-27)38-31(23)40-32;1-11-7-3-5-9-13(11)17-15(16)18-14-10-6-4-8-12(14)2;/h1-15H,(H-2,33,34,35,36,37,38,39,40,41,42,43);3-10H,1-2H3,(H3,16,17,18);/q-2;;+2

InChIKey

LIEQWFQJAQZZAS-UHFFFAOYSA-N

Smiles

Cc1ccccc1NC(=N)Nc2ccccc2C.O=S3(=O)O[Cu-]4N5\C\6=N/C7=N\C(=N/c8c9ccccc9c(\N=C\%10/N=C(\N=C/5\c%11cc3ccc6%11)c%12ccccc%10%12)n48)\c%13ccccc7%13