Information card for entry 2236642

Structure parameters

• Common name: Tris(η^5^-cyclopentadienyl)-[(tris-η^6^)-(9,10-dihydroanthracene-9,10-endo-\ 3',4'-(<i>N</i>-benzyl)-pyrrolidine)]-triruthenium(II) tris(hexafluorophosphate)
• Chemical name: Tris(η^5^-cyclopentadienyl)-tris[η^6^-[9,10-dihydroanthracene-9,10- <i>endo</i>-3',4'-(<i>N</i>-benzyl)pyrrolidine]]triruthenium(II) tris(hexafluorophosphate) acteone disolvate
• Formula: C46 H50 F18 N O2 P3 Ru3
• Calculated formula: C46 H50 F18 N O2 P3 Ru3
• Title of publication: Tris(η^5^-cyclopentadienyl)-tris[η^6^-[9,10-dihydroanthracene-9,10-<i>endo</i>-3',4'-(<i>N</i>-benzyl)pyrrolidine]]triruthenium(II) tris(hexafluorophosphate) acetone disolvate
• Authors of publication: Bratko, Ielyzaveta; Mallet-Ladeira, Sonia; Saffon, Nathalie; Teuma, Emmanuelle; Gómez, Montserrat
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 10
• Pages of publication: m1313 - m1314
• a: 9.6054 ± 0.0007 Å
• b: 36.567 ± 0.002 Å
• c: 14.4207 ± 0.001 Å
• α: 90°
• β: 105.038 ± 0.003°
• γ: 90°
• Cell volume: 4891.7 ± 0.6 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0999
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.0793
• Weighted residual factors for all reflections included in the refinement: 0.0934
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes