Information card for entry 7008198

Structure parameters

• Formula: C41 H52 Cl8 O P2 Pt Ru
• Calculated formula: C40 H51 Cl5 O P2 Pt Ru
• SMILES: [Pt]([P]12[Ru]3456789([C]1(=[C]3([C]4(=[C]25c1ccccc1)C)C)c1c2ccccc2ccc1OC)[c]1([c]6([c]7([c]8([c]91C)C)C)C)C)(Cl)(Cl)[P](CC)(CC)CC.C(Cl)(Cl)Cl
• Title of publication: Synthesis, structure and dynamics of methoxynaphthalene-substituted phospha-ruthenocenes and -ferrocenes.
• Authors of publication: Carmichael, Duncan; Ricard, Louis; Seeboth, Nicolas; Brown, John M.; Claridge, Timothy D. W.; Odell, Barbara
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 12
• Pages of publication: 2173 - 2181
• a: 9.809 ± 0.005 Å
• b: 24.651 ± 0.005 Å
• c: 19.909 ± 0.005 Å
• α: 90 ± 0.005°
• β: 91.42 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 4813 ± 3 ų
• Cell temperature: 293 ± 1 K
• Ambient diffraction temperature: 293 ± 1 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: 0.0753
• Residual factor for significantly intense reflections: 0.0584
• Weighted residual factors for significantly intense reflections: 0.1573
• Weighted residual factors for all reflections included in the refinement: 0.1796
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No