Information card for entry 4082849

Structure parameters

• Formula: C11 H16 O2 Ru Si2
• Calculated formula: C11 H16 O2 Ru Si2
• SMILES: [Ru]12345(C#[O])(C#[O])[c]6([cH]1[cH]2[cH]3[cH]46)[Si]([Si]5(C)C)(C)C
• Title of publication: StrainedansaHalf-Sandwich Complexes of Ruthenium and Osmium and a Non-Iron Metallopolymer by Ring-Opening Polymerization
• Authors of publication: Braunschweig, Holger; Dellermann, Theresa; Dewhurst, Rian D.; Mies, Jan; Radacki, Krzysztof; Stellwag-Konertz, Sascha; Vargas, Alfredo
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 7
• Pages of publication: 1536
• a: 12.2762 ± 0.0017 Å
• b: 9.3391 ± 0.0013 Å
• c: 13.0612 ± 0.0017 Å
• α: 90°
• β: 112.294 ± 0.005°
• γ: 90°
• Cell volume: 1385.5 ± 0.3 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0137
• Residual factor for significantly intense reflections: 0.0131
• Weighted residual factors for significantly intense reflections: 0.0355
• Weighted residual factors for all reflections included in the refinement: 0.0359
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No