Information card for entry 7011374

Structure parameters

• Formula: C34 H30 O10 Ru3 Si2
• Calculated formula: C34 H30 O10 Ru3 Si2
• SMILES: [Ru]123([Ru]45([Ru]61([OH]2)(C#[O])(C#[O])(C#[O])[C]([C]35=[C]4=C(c1ccccc1)c1ccccc1)(=[CH]6[Si](C)(C)C)C#C[Si](C)(C)C)(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: Some reactions of allenylidene-ruthenium cluster carbonyls with alkynes
• Authors of publication: Michael I. Bruce; Natasha N. Zaitseva; Brian W. Skelton; Allan H. White
• Journal of publication: J. Chem. Soc., Dalton Trans.
• Year of publication: 2002
• Journal issue: 8
• Pages of publication: 1678 - 1686
• a: 12.1663 ± 0.0006 Å
• b: 18.6509 ± 0.0009 Å
• c: 16.5147 ± 0.0008 Å
• α: 90°
• β: 96.171 ± 0.001°
• γ: 90°
• Cell volume: 3725.7 ± 0.3 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.065
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for all reflections: 0.032
• Weighted residual factors for all reflections included in the refinement: 0.029
• Goodness-of-fit parameter for all reflections: 0.993
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No