Information card for entry 4334113

Structure parameters

• Formula: C66 H68 Cl2 F12 N14 O4 P2 Ru3
• Calculated formula: C66 H68 Cl2 F12 N14 O4 P2 Ru3
• SMILES: c1[n]([Ru](Cl)([N]#C[Ru](C#[N][Ru]([n]2ccccc2)([n]2ccccc2)([n]2ccccc2)([n]2ccccc2)Cl)([n]2ccc(OC)cc2)([n]2ccc(OC)cc2)([n]2ccc(OC)cc2)[n]2ccc(OC)cc2)([n]2ccccc2)([n]2ccccc2)[n]2ccccc2)cccc1.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Communication between Remote Moieties in Linear Ru-Ru-Ru Trimetallic Cyanide-Bridged Complexes
• Authors of publication: German E. Pieslinger; Pablo Albores; Leonardo D. Slep; Benjamin J. Coe; Cliff J. Timpson; Luis M. Baraldo
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 2906 - 2917
• a: 14.2119 ± 0.0004 Å
• b: 14.2119 ± 0.0004 Å
• c: 18.9069 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3818.8 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 85
• Hermann-Mauguin space group symbol: P 4/n :2
• Hall space group symbol: -P 4a
• Residual factor for all reflections: 0.1614
• Residual factor for significantly intense reflections: 0.0906
• Weighted residual factors for significantly intense reflections: 0.2816
• Weighted residual factors for all reflections included in the refinement: 0.3071
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No