Information card for entry 1512605

Structure parameters

• Formula: C45 H45 O9 P3 Ru3
• Calculated formula: C45 H39 O9 P3 Ru3
• SMILES: [Ru]1([Ru]([Ru]1([P]1(C=C(C(=C1)C)C)c1ccccc1)(C#[O])(C#[O])C#[O])([P]1(C=C(C(=C1)C)C)c1ccccc1)(C#[O])(C#[O])C#[O])([P]1(C=C(C(=C1)C)C)c1ccccc1)(C#[O])(C#[O])C#[O]
• Title of publication: Insertion of a phospholide unit into a metalmetal bond: Synthesis and X-ray structure of [Ru3(CO)9(nu:?1:?5-PC4H2Me2)(?1-C6H5)]
• Authors of publication: Alejandro J. Arce; Ysaura De Sanctis; Maria Cristina Goite; Ruben Machado; Yomaira Otero; Teresa Gonzalez
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2012
• Journal volume: 392
• Pages of publication: 241 - 245
• a: 10.9509 ± 0.0013 Å
• b: 14.4682 ± 0.0019 Å
• c: 15.4482 ± 0.0018 Å
• α: 79.084 ± 0.011°
• β: 81.984 ± 0.011°
• γ: 81.475 ± 0.012°
• Cell volume: 2361.1 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0436
• Residual factor for significantly intense reflections: 0.0323
• Weighted residual factors for significantly intense reflections: 0.0767
• Weighted residual factors for all reflections included in the refinement: 0.0869
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No