Information card for entry 7707981

Structure parameters

• Formula: C29 H47 Cl P2 Ru
• Calculated formula: C29 H47 Cl P2 Ru
• Title of publication: Carbocyclic pincer carbene complexes of ruthenium: syntheses and reversible hydrogenation.
• Authors of publication: Wiedmaier, Nicholas R.; Schubert, Hartmut; Mayer, Hermann A.; Wesemann, Lars
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 34
• Pages of publication: 11814 - 11820
• a: 13.4968 ± 0.0005 Å
• b: 17.6039 ± 0.0006 Å
• c: 12.2964 ± 0.0005 Å
• α: 90°
• β: 104.829 ± 0.002°
• γ: 90°
• Cell volume: 2824.27 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0307
• Residual factor for significantly intense reflections: 0.0247
• Weighted residual factors for significantly intense reflections: 0.0593
• Weighted residual factors for all reflections included in the refinement: 0.062
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No