Information card for entry 4066631

Structure parameters

• Formula: C32 H20 N2 O4 Ru2
• Calculated formula: C32 H20 N2 O4 Ru2
• SMILES: [Ru]12345([Ru]6([n]7ccccc7[c]71[c]12[c]3(cccc1)[cH]4[cH]57)([n]1ccccc1C1=C6Cc2c1cccc2)(C#[O])C#[O])(C#[O])C#[O]
• Title of publication: Pyridyl-Substituted Indenyl Ruthenium Complexes: Synthesis, Structures, and Reactivities
• Authors of publication: Chen, Dafa; Zhang, Xi; Xu, Shansheng; Song, Haibin; Wang, Baiquan
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 15
• Pages of publication: 3418
• a: 9.7603 ± 0.0013 Å
• b: 17.94 ± 0.003 Å
• c: 15.399 ± 0.002 Å
• α: 90°
• β: 94.397 ± 0.003°
• γ: 90°
• Cell volume: 2688.4 ± 0.7 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 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: 0.0913
• Residual factor for significantly intense reflections: 0.0407
• Weighted residual factors for significantly intense reflections: 0.0731
• Weighted residual factors for all reflections included in the refinement: 0.088
• Goodness-of-fit parameter for all reflections included in the refinement: 0.99
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No