Information card for entry 4064387

Structure parameters

• Formula: C30 H23 O6 P Ru3
• Calculated formula: C30 H23 O6 P Ru3
• SMILES: [Ru]123([Ru]45([Ru]6789(C#[O])(C#[O])[c]%10%11[C]4(=[CH]5[CH]1=[C]3(C)[c]%106[cH]9[cH]8[c]7%11C)C)([P]2(c1ccccc1)c1ccccc1)(C#[O])C#[O])(C#[O])C#[O]
• Title of publication: Trinuclear and Tetranuclear Ruthenium Carbonyl Clusters Derived from Indenylphosphines: Cleavage of C−H and C−P Bonds
• Authors of publication: Tan, Xing; Li, Bin; Xu, Shansheng; Song, Haibin; Wang, Baiquan
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 8
• Pages of publication: 2308
• a: 9.6491 ± 0.0019 Å
• b: 9.951 ± 0.002 Å
• c: 15.95 ± 0.003 Å
• α: 86.84 ± 0.03°
• β: 79 ± 0.03°
• γ: 66.39 ± 0.03°
• Cell volume: 1377.1 ± 0.6 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 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: 0.0259
• Residual factor for significantly intense reflections: 0.0231
• Weighted residual factors for significantly intense reflections: 0.058
• Weighted residual factors for all reflections included in the refinement: 0.0592
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No