chempirical

Chloro(cyclopentadienyl)bis(triphenylphosphine)ruthenium

C41H35ClP2RuCAS 32993-05-8726.20 g/mol

Open in Covalent MOL file
Cl−Ru2+HC−PP
Phosphine

Properties

Molecular formula
C41H35ClP2Ru
Molar mass
726.20 g/mol
Exact mass
726.0946 Da
logP
5.30Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
6

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
32993-05-8
SMILES
[Cl-].[Ru+2].c1cc[cH-]c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
InChIKey
QHMOWPJARYQHOB-UHFFFAOYSA-M
InChI
InChI=1S/2C18H15P.C5H5.ClH.Ru/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-4-5-3-1;;/h2*1-15H;1-5H;1H;/q;;-1;;+2/p-1

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Names and synonyms

13 names · show all
  • Ruthenium, chloro(η5-2,4-cyclopentadien-1-yl)bis(triphenylphosphine)-
  • Ruthenium, chloro-π-cyclopentadienylbis(triphenylphosphine)-
  • Chloro(η5-2,4-cyclopentadien-1-yl)bis(triphenylphosphine)ruthenium
  • Chloro-π-cyclopentadienylbis(triphenylphosphine)ruthenium
  • Chloro(η5-cyclopentadienyl)bis(triphenylphosphine)ruthenium
  • Bis(triphenylphosphine)cyclopentadienylruthenium chloride
  • η5-Cyclopentadienylbis(triphenylphosphine)ruthenium chloride
  • Chloro(cyclopentadienyl)bis(triphenylphosphine)ruthenium(II)
  • Cyclopentadienylbis(triphenylphosphine)ruthenium chloride
  • Chloro(η-cyclopentadienyl)bis(triphenylphosphine)ruthenium
  • Bis(triphenylphosphine)(chloro)cyclopentadienylruthenium
  • Bis(triphenylphosphine)(cyclopentadiene)ruthenium chloride
  • Chloro(eta5-cyclopentadienyl)bis(triphenylphosphine)ruthenium

Work with Chloro(cyclopentadienyl)bis(triphenylphosphine)ruthenium

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Dichlorotris(triphenylphosphine)ruthenium(II)15529-49-474 % similar Dicarbonyldichlorobis(triphenylphosphine)ruthenium14564-35-359 % similar Bis(triphenylphosphine)palladium chloride13965-03-258 % similar Chloro(triphenylphosphine)gold(I)14243-64-258 % similar Bis(triphenylphosphine)nickel dichloride14264-16-558 % similar Wilkinson's catalyst14694-95-258 % similar cis-Bis(triphenylphosphine)platinum(II) chloride15604-36-158 % similar Chlorotris(triphenylphosphine)rhodium(I)16592-65-758 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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