Information card for entry 2207214

Structure parameters

• Chemical name: Di-μ-pivalamidato-bis[dicarbonyl(triphenylphosphine)ruthenium(II)](Ru—Ru)
• Formula: C50 H50 N2 O6 P2 Ru2
• Calculated formula: C50 H50 N2 O6 P2 Ru2
• SMILES: [Ru]12([Ru](C#[O])(C#[O])(NC(C(C)(C)C)=[O]2)([O]=C(C(C)(C)C)N1)[P](c1ccccc1)(c1ccccc1)c1ccccc1)(C#[O])(C#[O])[P](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Di-μ-pivalamidato-bis[dicarbonyl(triphenylphosphine)ruthenium(II)](Ru—Ru)
• Authors of publication: Auzias, Mathieu; Therrien, Bruno; Süss-Fink, Georg
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 11
• Pages of publication: m2426 - m2427
• a: 15.5453 ± 0.0012 Å
• b: 17.5491 ± 0.0014 Å
• c: 18.1924 ± 0.0012 Å
• α: 90°
• β: 108.262 ± 0.008°
• γ: 90°
• Cell volume: 4713 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0694
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for significantly intense reflections: 0.0635
• Weighted residual factors for all reflections included in the refinement: 0.0683
• Goodness-of-fit parameter for all reflections included in the refinement: 0.828
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes