Information card for entry 4109533

Structure parameters

• Formula: C42 H49 O4 P Pd Ru Sn
• Calculated formula: C42 H49 O4 P Pd Ru Sn
• SMILES: [Pd]123([Ru]([Sn](c4ccccc4)(c4ccccc4)c4ccccc4)([C]2(=[CH2]1)c1ccccc1)(C#[O])(C#[O])(C#[O])C3=O)[P](C(C)(C)C)(C(C)(C)C)C(C)(C)C
• Title of publication: Activation of Metal Hydride Complexes by Tri-tert-butylphosphine-Platinum and -Palladium Groups
• Authors of publication: Richard D. Adams; Burjor Captain; Eszter Trufan; Lei Zhu
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2007
• Journal volume: 129
• Pages of publication: 7545 - 7556
• a: 11.5256 ± 0.0005 Å
• b: 12.7825 ± 0.0006 Å
• c: 17.0037 ± 0.0008 Å
• α: 101.212 ± 0.001°
• β: 106.474 ± 0.001°
• γ: 103.063 ± 0.001°
• Cell volume: 2248.67 ± 0.18 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0672
• Residual factor for significantly intense reflections: 0.0469
• Weighted residual factors for significantly intense reflections: 0.1532
• Weighted residual factors for all reflections included in the refinement: 0.1729
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No