Information card for entry 4107597

Structure parameters

• Common name: Tip3Ph2-Chlorocyclotrisilan
• Chemical name: [S]-1-Chlor-1,2,2-tris(2',4',6'-triisopropylphenyl)-3,3-diphenylcyclotrisilan
• Formula: C61 H87 Cl O Si3
• Calculated formula: C61 H87 Cl O Si3
• Title of publication: Syntheses of Trisila Analogues of Allyl Chlorides and Their Transformations to Chlorocyclotrisilanes, Cyclotrisilanides, and a Trisilaindane
• Authors of publication: Kai Abersfelder; David Scheschkewitz
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2008
• Journal volume: 130
• Pages of publication: 4114 - 4121
• a: 10.874 ± 0.0005 Å
• b: 15.4908 ± 0.0008 Å
• c: 34.2768 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5773.8 ± 0.5 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0684
• Residual factor for significantly intense reflections: 0.0671
• Weighted residual factors for significantly intense reflections: 0.1542
• Weighted residual factors for all reflections included in the refinement: 0.1548
• Goodness-of-fit parameter for all reflections included in the refinement: 1.307
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No