Information card for entry 4066640

Structure parameters

• Formula: C23 H15 N O7 Ru2
• Calculated formula: C23 H15 N O7 Ru2
• SMILES: c1cccc2[c]34[c]56[cH]7[c]89[c]3(cccc8)[Ru]4679(C#[O])(C#[O])[Ru](C5CC(=O)OC)(C#[O])(C#[O])(C#[O])[n]12
• 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: 9.894 ± 0.004 Å
• b: 13.51 ± 0.005 Å
• c: 17.462 ± 0.007 Å
• α: 90°
• β: 103.87 ± 0.004°
• γ: 90°
• Cell volume: 2266.1 ± 1.5 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0265
• Residual factor for significantly intense reflections: 0.0231
• Weighted residual factors for significantly intense reflections: 0.0487
• Weighted residual factors for all reflections included in the refinement: 0.0502
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No