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Substance Name: Ruthenium(2+), tris(acetonitrile)((2-((diphenylphosphino-kappaP)methyl)-2-methyl-1,3-propanediyl)bis(diphenylphosphine-kappaP))-, (OC-6-22)-,salt with trifluoromethanesulfonic acid (1:2)
RN: 103500-16-9
InChIKey: HYZMSSPZXLGACV-UHFFFAOYSA-L

Molecular Formula

  • C41-H39-P3.3(C2-H3-N).2(C-F3-O3-S).Ru

Molecular Weight

  • 1147.0452
 
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Names and Synonyms

Synonym

  • (Ru(MeCN)3(PPP))(OTf)2

Systematic Name

  • Ruthenium(2+), tris(acetonitrile)((2-((diphenylphosphino-kappaP)methyl)-2-methyl-1,3-propanediyl)bis(diphenylphosphine-kappaP))-, (OC-6-22)-,salt with trifluoromethanesulfonic acid (1:2)

Registry Numbers

CAS Registry Number

  • 103500-16-9

System Generated Number

  • 0103500169

Molecular Formulas

Molecular Formula

  • C41-H39-P3.3(C2-H3-N).2(C-F3-O3-S).Ru

Molecular Formula Fragments

  • C-F3-O3-S
  • C2-H3-N
  • C41-H39-P3
  • COMPONENT
  • Ru

Structure Descriptors

InChI

1S/C41H39P3.3C2H3N.2CHF3O3S.Ru/c1-41(32-42(35-20-8-2-9-21-35)36-22-10-3-11-23-36,33-43(37-24-12-4-13-25-37)38-26-14-5-15-27-38)34-44(39-28-16-6-17-29-39)40-30-18-7-19-31-40;3*1-2-3;2*2-1(3,4)8(5,6)7;/h2-31H,32-34H2,1H3;3*1H3;2*(H,5,6,7);/q;;;;;;+2/p-2

InChIKey

HYZMSSPZXLGACV-UHFFFAOYSA-L

Smiles

CC#N.CC#N.CC#N.CC(CP(c1ccccc1)c2ccccc2)(CP(c3ccccc3)c4ccccc4)CP(c5ccccc5)c6ccccc6.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Ru+2]