Information card for entry 4113529

Structure parameters

• Formula: C19 H32 O3 Si W
• Calculated formula: C19 H32 O3 Si W
• SMILES: [W]12345([O]([Si](C1C(C)C)(C)C)C)(C#[O])(C#[O])[c]1([c]2([c]3([c]4([c]51C)C)C)C)C
• Title of publication: Novel η3-1-Silaallyl Tungsten Complexes via Si-H Bond Activation of Hydrovinylsilanes: Structure and Reactivity toward Methanol
• Authors of publication: Hiroyuki Sakaba; Sanae Watanabe; Chizuko Kabuto; Kuninobu Kabuto
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2003
• Journal volume: 125
• Pages of publication: 2842 - 2843
• a: 15.805 ± 0.003 Å
• b: 8.606 ± 0.002 Å
• c: 15.728 ± 0.003 Å
• α: 90°
• β: 102.802 ± 0.003°
• γ: 90°
• Cell volume: 2086.1 ± 0.7 ų
• Cell temperature: 150.2 K
• Number of distinct elements: 5
• 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: 0.0353
• Residual factor for significantly intense reflections: 0.0273
• Weighted residual factors for significantly intense reflections: 0.0609
• Weighted residual factors for all reflections included in the refinement: 0.0642
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No