Information card for entry 4066632

Structure parameters

• Formula: C21 H9 N O7 Ru3
• Calculated formula: C21 H9 N O7 Ru3
• SMILES: [Ru]123456([Ru]789([Ru]%10([n]%11c([C]%129=[C]8%10C7[c]75[c]6%12[cH]1[cH]2[cH]3[cH]47)cccc%11)(C#[O])(C#[O])C#[O])(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: 7.1276 ± 0.0014 Å
• b: 9.6244 ± 0.0019 Å
• c: 16.457 ± 0.003 Å
• α: 104.779 ± 0.003°
• β: 97.07 ± 0.003°
• γ: 103.93 ± 0.003°
• Cell volume: 1038.8 ± 0.3 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: 0.0347
• Residual factor for significantly intense reflections: 0.0247
• Weighted residual factors for significantly intense reflections: 0.0488
• Weighted residual factors for all reflections included in the refinement: 0.052
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No