Copper, hexa-μ3-hydrohexakis(triphenylphosphine)hexa-, octahedro

CAS Registry Number®

33636-93-0
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CAS Name

Copper, hexa-μ3-hydrohexakis(triphenylphosphine)hexa-, octahedro

Molecular Formula

C108H96Cu6P6

Cite this Page

Copper, hexa-μ3-hydrohexakis(triphenylphosphine)hexa-, octahedro.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=33636-93-0 (retrieved 2024-03-28) (CAS RN: 33636-93-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/6C18H15P.6Cu.6H/c6*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;;;;;;;;;;/h6*1-15H;;;;;;;;;;;;/q;;;;;;6*+1;6*-1

InChIKey

InChIKey=ULHDRBNWPMPZLA-UHFFFAOYSA-N

SMILES

[P]([Cu+]123456[Cu+]789%10%11([P](C%12=CC=CC=C%12)(C%13=CC=CC=C%13)C%14=CC=CC=C%14)[Cu+]1%15%16%17%18([P](C%19=CC=CC=C%19)(C%20=CC=CC=C%20)C%21=CC=CC=C%21)[Cu+]2%22%23%24([P](C%25=CC=CC=C%25)(C%26=CC=CC=C%26)C%27=CC=CC=C%27)([Cu+]37%28([P](C%29=CC=CC=C%29)(C%30=CC=CC=C%30)C%31=CC=CC=C%31)([H-]4%22)([H-]58)[Cu+]9%23%15([P](C%32=CC=CC=C%32)(C%33=CC=CC=C%33)C%34=CC=CC=C%34)([H-]%10%28)([H-]%11%16)[H-]%24%17)[H-]6%18)(C%35=CC=CC=C%35)(C%36=CC=CC=C%36)C%37=CC=CC=C%37

Canonical SMILES

C=1C=CC(=CC1)[P](C=2C=CC=CC2)(C=3C=CC=CC3)[Cu+]456789[H-]%10[Cu+]%11%12%13%149([H-]%15[Cu+]%16%17%18%19%14([H-]%11[Cu+]%10%20%19%138([H-]7[Cu+]%21%22%18%206([H-]%16[Cu+]%15%17%12%225([H-]%214)[P](C=%23C=CC=CC%23)(C=%24C=CC=CC%24)C=%25C=CC=CC%25)[P](C=%26C=CC=CC%26)(C=%27C=CC=CC%27)C=%28C=CC=CC%28)[P](C=%29C=CC=CC%29)(C=%30C=CC=CC%30)C=%31C=CC=CC%31)[P](C=%32C=CC=CC%32)(C=%33C=CC=CC%33)C=%34C=CC=CC%34)[P](C=%35C=CC=CC%35)(C=%36C=CC=CC%36)C=%37C=CC=CC%37

Other Names for this Substance

  • Copper, hexa-μ3-hydrohexakis(triphenylphosphine)hexa-, octahedro
  • (Triphenylphosphine)copper hydride, hexamer
  • Hexahydrohexakis(triphenylphosphine)hexacopper
  • Stryker's reagent

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