Information card for entry 4070787

Structure parameters

• Formula: C23 H56 O Si6
• Calculated formula: C23 H56 O Si6
• SMILES: [Si@@]1(OC)(/C(=C/C([Si](C)(C)C)[Si](C)(C)C)[C@H]([Si](C)(C)C)[C@@H]([Si](C)(C)C)[C@@H]1[Si](C)(C)C)C.[Si@]1(OC)(/C(=C/C([Si](C)(C)C)[Si](C)(C)C)[C@@H]([Si](C)(C)C)[C@H]([Si](C)(C)C)[C@H]1[Si](C)(C)C)C
• Title of publication: An Unexpected Ring Contraction: Phenylsilane to Silacyclopentane
• Authors of publication: Lim, Young Mook; Lee, Myong Euy
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 5
• Pages of publication: 1000
• a: 9.33 ± 0.005 Å
• b: 13.422 ± 0.007 Å
• c: 14.544 ± 0.008 Å
• α: 82.699 ± 0.01°
• β: 82.082 ± 0.01°
• γ: 71.186 ± 0.009°
• Cell volume: 1700.9 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1206
• Residual factor for significantly intense reflections: 0.066
• Weighted residual factors for significantly intense reflections: 0.1583
• Weighted residual factors for all reflections included in the refinement: 0.1756
• Goodness-of-fit parameter for all reflections included in the refinement: 0.972
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No