Information card for entry 4308240

Structure parameters

• Formula: C22 H52 F N P2 Ru Si2
• Calculated formula: C22 H52 F N P2 Ru Si2
• SMILES: [Ru]12([P](C[Si](N2[Si](C)(C)C[P]1(C(C)(C)C)C(C)(C)C)(C)C)(C(C)(C)C)C(C)(C)C)F
• Title of publication: Influence of Chelate Substituents on the Structure and Spin State of Unsaturated [N(SiMe2CH2PtBu2)2]Ru-X
• Authors of publication: Xiaofan Yang; Amy Walstrom; Nikolay Tsvetkov; Maren Pink; Kenneth G. Caulton
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 4612 - 4616
• a: 17.8638 ± 0.001 Å
• b: 11.0914 ± 0.0006 Å
• c: 16.4562 ± 0.0009 Å
• α: 90°
• β: 117.328 ± 0.001°
• γ: 90°
• Cell volume: 2896.6 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0348
• Residual factor for significantly intense reflections: 0.0282
• Weighted residual factors for significantly intense reflections: 0.0635
• Weighted residual factors for all reflections included in the refinement: 0.0678
• Goodness-of-fit parameter for all reflections included in the refinement: 1.13
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No