Information card for entry 7006896

Structure parameters

• Formula: C55 H64 Cl2 O10 P2 Ru4
• Calculated formula: C55 H64 Cl2 O10 P2 Ru4
• SMILES: [Ru]1([H][Ru](C#[O])(C#[O])(C#[O])[H][Ru]([H][Ru](C#[O])(C#[O])(C#[O])[H]1)([P](c1ccccc1)(c1ccccc1)[C@H]1C[C@@H](CC[C@H]1C(C)C)C)(C#[O])C#[O])([P](c1ccccc1)(c1ccccc1)[C@H]1C[C@@H](CC[C@H]1C(C)C)C)(C#[O])C#[O].ClCCl
• Title of publication: Synthesis, characterization and reactivity of tetranuclear ruthenium hydrido clusters containing chiral phosphine ligands.
• Authors of publication: Moberg, Viktor; Homanen, Pertti; Selva, Simona; Persson, Roger; Haukka, Matti; Pakkanen, Tapani A.; Monari, Magda; Nordlander, Ebbe
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 1
• Pages of publication: 279 - 288
• a: 9.3092 ± 0.0019 Å
• b: 19.38 ± 0.004 Å
• c: 15.867 ± 0.003 Å
• α: 90°
• β: 90.51 ± 0.03°
• γ: 90°
• Cell volume: 2862.5 ± 1 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0178
• Residual factor for significantly intense reflections: 0.0169
• Weighted residual factors for significantly intense reflections: 0.0399
• Weighted residual factors for all reflections included in the refinement: 0.0405
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No