(Ru(MeCN)3(CF3PPP))(OTf)2
Basic information
- CAS
207747-34-0- Standard SMILES
CC#N.CC#N.CC#N.CC(CP(c1cccc(C(F)(F)F)c1)c1cccc(C(F)(F)F)c1)(CP(c1cccc(C(F)(F)F)c1)c1cccc(C(F)(F)F)c1)CP(c1cccc(C(F)(F)F)c1)c1cccc(C(F)(F)F)c1.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Ru+2]- InChIKey
YHWMLYKGIRHYQY-UHFFFAOYSA-L- Molecular formula
- C55H42F24N3O6P3RuS2
- Average molar mass
- 1,555 g/mol
- Monoisotopic mass
- 1,555.038806
Names & identifiers
- Preferred name
- (Ru(MeCN)3(CF3PPP))(OTf)2
- IUPAC
- tris(acetonitrile);[3-bis[3-(trifluoromethyl)phenyl]phosphanyl-2-[bis[3-(trifluoromethyl)phenyl]phosphanylmethyl]-2-methylpropyl]-bis[3-(trifluoromethyl)phenyl]phosphane;ruthenium(2+);bis(trifluoromethanesulfonate)
Names & synonyms
(Ru(MeCN)3(CF3PPP))(OTf)2207747-34-0[Ru(MeCN)3(CF3PPP)](OTf)2Ruthenium(2+), tris(acetonitrile)((2-((bis(3-(trifluoromethyl)phenyl)phosphino-kappaP)methyl)-2-methyl-1,3-propanediyl)bis(bis(3-(trifluoromethyl)phenyl)phosphine-kappaP))-, (OC-6-22)-, salt with trifluoromethanesulfonic acid (1:2)DTXSID80174854acetonitrile; [3-bis[3-(trifluoromethyl)phenyl]phosphanyl-2-[bis[3-(trifluoromethyl)phenyl]phosphanylmethyl]-2-methyl-propyl]-bis[3-(trifluoromethyl)phenyl]phosphane; ruthenium(2+); trifluoromethanesulfonic acidRuthenium(2+), tris(acetonitrile)[[2-[[bis[3-(trifluoromethyl)phenyl]phosphino-.kappa.P]methyl]-2-methyl-1,3-propanediyl]bis[bis[3- (trifluoromethyl)phenyl]phosphine-.kappa.P]]-, (OC-6-22)-, salt with trifluoromethanesulfonic acid (1:2)
Database identifiers
- CAS
207747-34-0- PubChem CID
- 492273
- DTXSID
DTXSID80174854
Properties
Computed structural properties
- Topological polar surface area
- 203 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 33
- Rotatable bonds
- 12
- Heavy atoms
- 94
- Formal charge
- 0
- Complexity
- 1,470
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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