Information card for entry 4082632

Structure parameters

• Formula: C22 H60 O Si9
• Calculated formula: C22 H60 O Si9
• SMILES: [Si]([Si]1([Si]([Si]([Si]([Si]([Si]1(C)C)(C)C)([Si](C)(C)C)C(=O)C(C)(C)C)(C)C)(C)C)[Si](C)(C)C)(C)(C)C
• Title of publication: Photoinduced Brook-Type Rearrangement of Acylcyclopolysilanes.
• Authors of publication: Stueger, Harald; Hasken, Bernd; Haas, Michael; Rausch, Martin; Fischer, Roland; Torvisco, Ana
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 1
• Pages of publication: 231 - 239
• a: 13.8325 ± 0.0006 Å
• b: 17.2254 ± 0.0007 Å
• c: 16.2546 ± 0.0007 Å
• α: 90°
• β: 102.386 ± 0.001°
• γ: 90°
• Cell volume: 3782.8 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0423
• Residual factor for significantly intense reflections: 0.0309
• Weighted residual factors for significantly intense reflections: 0.0772
• Weighted residual factors for all reflections included in the refinement: 0.0846
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No