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Substance Name: (RhCl2(MeCN)(PPP))(OTf)
RN: 128137-77-9
InChIKey: KLHXADFHLFDEIN-UHFFFAOYSA-K

Molecular Formula

  • C41-H39-P3.C2-H3-N.C-F3-O3-S.2Cl.Rh

Molecular Weight

  • 988.6178
 
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Names and Synonyms

Results Name

  • (RhCl2(MeCN)(PPP))(OTf)

Synonym

  • (RhCl2(MeCN)(PPP))(OTf)

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 128137-77-9

System Generated Number

  • 0128137779

Molecular Formulas

Molecular Formula

  • C41-H39-P3.C2-H3-N.C-F3-O3-S.2Cl.Rh

Molecular Formula Fragments

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

Structure Descriptors

InChI

1S/C41H39P3.C2H3N.CHF3O3S.2ClH.Rh/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;1-2-3;2-1(3,4)8(5,6)7;;;/h2-31H,32-34H2,1H3;1H3;(H,5,6,7);2*1H;/q;;;;;+3/p-3

InChIKey

KLHXADFHLFDEIN-UHFFFAOYSA-K

Smiles

CC#N.CC(CP(c1ccccc1)c2ccccc2)(CP(c3ccccc3)c4ccccc4)CP(c5ccccc5)c6ccccc6.C(F)(F)(F)S(=O)(=O)[O-].[Cl-].[Cl-].[Rh+3]