Information card for entry 4103627

Structure parameters

• Common name: meta-Phenylene-tetrasiladiene
• Chemical name: 1,3-Bis[1',2',2'-Tris(2'',4'',6''-triisopropylphenyl)disilenyl]benzene
• Formula: C117 H163 Si4
• Calculated formula: C117 H163 Si4
• 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: 10.2487 ± 0.0007 Å
• b: 21.606 ± 0.0015 Å
• c: 26.9115 ± 0.0019 Å
• α: 68.187 ± 0.002°
• β: 81.34 ± 0.002°
• γ: 82.16 ± 0.002°
• Cell volume: 5448.3 ± 0.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0824
• Residual factor for significantly intense reflections: 0.0656
• Weighted residual factors for significantly intense reflections: 0.1484
• Weighted residual factors for all reflections included in the refinement: 0.1585
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No