Information card for entry 7704358

Structure parameters

• Formula: C31 H48 O2 P2 Ru
• Calculated formula: C31 H48 O2 P2 Ru
• SMILES: [RuH]12([P](CC3=Cc4c(cccc4)C=C(C23)C[P]1(C(C)(C)C)C(C)(C)C)(C(C)(C)C)C(C)(C)C)(C#[O])C#[O]
• Title of publication: Conformation controlled stepwise hydride shuffling from the metal to the ligand backbone.
• Authors of publication: Wiedmaier, Nicholas R.; Speth, Hansjörg; Leistikow, Georg; Eichele, Klaus; Schubert, Hartmut; Mayer, Hermann A.; Wesemann, Lars
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 21
• Pages of publication: 7218 - 7227
• a: 11.7759 ± 0.0002 Å
• b: 12.0484 ± 0.0002 Å
• c: 13.1386 ± 0.0002 Å
• α: 100.481 ± 0.001°
• β: 106.242 ± 0.001°
• γ: 117.299 ± 0.001°
• Cell volume: 1481.55 ± 0.05 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0239
• Residual factor for significantly intense reflections: 0.0201
• Weighted residual factors for significantly intense reflections: 0.0473
• Weighted residual factors for all reflections included in the refinement: 0.0488
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No