Information card for entry 2011716

Structure parameters

• Formula: C23 H23 N O2 S Si
• Calculated formula: C23 H23 N O2 S Si
• SMILES: S(=O)(=O)(N1[C@@H]2C[Si](C[C@H]12)(c1ccccc1)c1ccccc1)c1ccc(cc1)C
• Title of publication: 3,3-Diphenyl-6-(<i>p</i>-toluenesulfonyl)-6-aza-3-silabicyclo[3.1.0]hexane
• Authors of publication: Matthews, Jennifer L.; McArthur, Duncan R.; Muir, Kenneth W.; White, David N.J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 1
• Pages of publication: 120 - 122
• a: 9.2955 ± 0.0001 Å
• b: 8.6076 ± 0.0001 Å
• c: 26.5354 ± 0.0003 Å
• α: 90°
• β: 96.44 ± 0.001°
• γ: 90°
• Cell volume: 2109.75 ± 0.04 ų
• Cell temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for all reflections included in the refinement: 0.116
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes