Information card for entry 4066639

Structure parameters

• Formula: C25 H16 N2 O4 Ru2
• Calculated formula: C25 H16 N2 O4 Ru2
• SMILES: [Ru]12345([Ru]67([n]8ccccc8[c]81[c]12[c]3(cccc1)[cH]4[c]58C7Cc1[n]6cccc1)(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: 9.4777 ± 0.0013 Å
• b: 15.288 ± 0.002 Å
• c: 16.231 ± 0.002 Å
• α: 90°
• β: 106.233 ± 0.002°
• γ: 90°
• Cell volume: 2258 ± 0.5 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: 0.0363
• Residual factor for significantly intense reflections: 0.0231
• Weighted residual factors for significantly intense reflections: 0.0517
• Weighted residual factors for all reflections included in the refinement: 0.0575
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No