Information card for entry 4072399

Structure parameters

• Formula: C22 H66 Si11
• Calculated formula: C22 H66 Si11
• SMILES: [Si]1([Si]([Si]([Si]([Si]([Si]([Si]1(C)C)([Si](C)(C)C)[Si](C)(C)C)(C)C)(C)C)(C)C)(C)C)([Si](C)(C)C)[Si](C)(C)C
• Title of publication: Synthesis of Cyclic and Bicyclic Polysilanes of Variable Ring Sizes
• Authors of publication: Zirngast, Michaela; Baumgartner, Judith; Marschner, Christoph
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 24
• Pages of publication: 6472
• a: 17.892 ± 0.004 Å
• b: 18.938 ± 0.004 Å
• c: 25.108 ± 0.005 Å
• α: 90°
• β: 94.27 ± 0.03°
• γ: 90°
• Cell volume: 8484 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• 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: 0.1408
• Residual factor for significantly intense reflections: 0.0624
• Weighted residual factors for significantly intense reflections: 0.1232
• Weighted residual factors for all reflections included in the refinement: 0.151
• Goodness-of-fit parameter for all reflections included in the refinement: 0.94
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No