Information card for entry 4084864

Structure parameters

• Formula: C41 H39 O11 P Ru3
• Calculated formula: C41 H39 O11 P Ru3
• SMILES: [Ru]1([Ru]([Ru]1(C#[O])(C#[O])(C#[O])C#[O])(C#[O])(C#[O])(C#[O])C#[O])(C#[O])(C#[O])(C#[O])[P](C1=C(Cc2c1cccc2)c1c(cc(cc1C)C)C)(C1CCCCC1)C1CCCCC1
• Title of publication: Indenyl Ruthenium Complexes with an Unusual η3Coordination Mode
• Authors of publication: Yuan, Jia; Han, Zhi-Jun; Peng, Hui; Pi, Yun-Xiao; Chen, You; Liu, Sheng-Hua; Yu, Guang-Ao
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 24
• Pages of publication: 7325
• a: 10.8501 ± 0.0014 Å
• b: 19.699 ± 0.003 Å
• c: 19.699 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4210.4 ± 0.8 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0558
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.0989
• Weighted residual factors for all reflections included in the refinement: 0.1134
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No