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Substance Name: (29H,31H-Phthalocyanine-1,8,16,23-tetrathiolato(2-)-N29,N30,N31,N32)copper, tetrasodium salt
RN: 94277-73-3
InChIKey: KOXNYBMJEJWEAP-UHFFFAOYSA-J

Molecular Formula

  • C32-H16-Cu-N8-S4.4Na

Molecular Weight

  • 792.2728
 
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Names and Synonyms

Synonym

  • EINECS 304-658-2

Systematic Name

  • (29H,31H-Phthalocyanine-1,8,16,23-tetrathiolato(2-)-N29,N30,N31,N32)copper, tetrasodium salt

Registry Numbers

CAS Registry Number

  • 94277-73-3

System Generated Number

  • 0094277733

Molecular Formulas

Molecular Formula

  • C32-H16-Cu-N8-S4.4Na

Molecular Formula Fragments

  • C32-H16-Cu-N8-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C32H16N8S4.Cu.4Na/c41-13-7-9-15-19(11-13)30-34-25(15)33-29-20-12-14(42)8-10-16(20)26(35-29)37-31-24-18(4-2-6-22(24)44)28(39-31)40-32-23-17(27(36-30)38-32)3-1-5-21(23)43;;;;;/h1-12H,(H4-2,33,34,35,36,37,38,39,40,41,42,43,44);;;;;/q-2;+2;4*+1/p-4

InChIKey

KOXNYBMJEJWEAP-UHFFFAOYSA-J

Smiles

c1cc\2c(c(c1)[S-])/c/3n/c-4n/c(n\c5c6ccc(cc6c/7n5[Cu]n3/c2n\c-8n/c(n7)/c9c8cc(cc9)[S-])[S-])/c1c4cccc1[S-].[Na+].[Na+].[Na+].[Na+]