Information card for entry 4103625

Structure parameters

• Chemical name: 1-(para-Chlorophenyl)-1,2,2-(2',4',6'-triisopropylphenyl)disilene
• Formula: C51 H73 Cl Si2
• Calculated formula: C51 H73 Cl Si2
• Title of publication: Transfer of a Disilenyl Moiety to Aromatic Substrates and Lateral Functional Group Transformation in Aryl Disilenes
• Authors of publication: Jonathan Jeck; Iulia Bejan; Andrew J. P. White; Dominik Nied; Frank Breher; David Scheschkewitz
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 17306 - 17315
• a: 18.55902 ± 0.00009 Å
• b: 12.81965 ± 0.00005 Å
• c: 21.65869 ± 0.00009 Å
• α: 90°
• β: 109.634 ± 0.0005°
• γ: 90°
• Cell volume: 4853.43 ± 0.04 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• 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: 0.0434
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for significantly intense reflections: 0.105
• Weighted residual factors for all reflections included in the refinement: 0.1081
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No