Information card for entry 4066641

Structure parameters

• Formula: C25 H21 N O7 Ru2
• Calculated formula: C25 H21 N O7 Ru2
• SMILES: [Ru]1234567([Ru]8([O]=C(OC)[CH]7=[CH2]6)([n]6ccccc6[c]61[c]12cccc[c]31[cH]4[c]56C8CC(=O)OC)(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: 10.344 ± 0.003 Å
• b: 11.453 ± 0.003 Å
• c: 11.747 ± 0.004 Å
• α: 66.805 ± 0.004°
• β: 66.35 ± 0.005°
• γ: 74.733 ± 0.004°
• Cell volume: 1162.5 ± 0.6 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0341
• Residual factor for significantly intense reflections: 0.0242
• Weighted residual factors for significantly intense reflections: 0.0625
• Weighted residual factors for all reflections included in the refinement: 0.0738
• Goodness-of-fit parameter for all reflections included in the refinement: 0.778
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No