Information card for entry 4120680

Structure parameters

• Formula: C32 H58 Ge O4 Si3 W
• Calculated formula: C32 H58 Ge O4 Si3 W
• SMILES: [W]123456(C#[O])(C#[O])([c]7([c]4([c]3([c]2([c]17C)C)C)C)C)C[CH]5=[C]6(CC)O[Ge]1(CC=C(CC)O1)C([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C
• Title of publication: Reactions of a Tungsten-Germylyne Complex with α,β-Unsaturated Ketones: Complete Cleavage of the W≡Ge Bond and Formation of Two Types of η(3)-Germoxyallyl Tungsten Complexes.
• Authors of publication: Fukuda, Tetsuya; Hashimoto, Hisako; Tobita, Hiromi
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 1
• Pages of publication: 80 - 83
• a: 16.9057 ± 0.0006 Å
• b: 10.5686 ± 0.0004 Å
• c: 21.5417 ± 0.001 Å
• α: 90°
• β: 101.02 ± 0.0017°
• γ: 90°
• Cell volume: 3777.9 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.0585
• Residual factor for significantly intense reflections: 0.0481
• Weighted residual factors for significantly intense reflections: 0.0994
• Weighted residual factors for all reflections included in the refinement: 0.111
• Goodness-of-fit parameter for all reflections included in the refinement: 1.264
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No