Information card for entry 4071629

Structure parameters

• Chemical name: 1-(4-trimetylsilylphenyl)- 2,3,4,5-tetraphenylborole
• Formula: C37 H30 B Si
• Calculated formula: C37 H30 B Si
• Title of publication: Synthesis and Structural Characterization of Pentaarylboroles and Their Dianions
• Authors of publication: So, Cheuk-Wai; Watanabe, Daisuke; Wakamiya, Atsushi; Yamaguchi, Shigehiro
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 14
• Pages of publication: 3496
• a: 18.9 ± 0.005 Å
• b: 15.875 ± 0.004 Å
• c: 19.674 ± 0.005 Å
• α: 90°
• β: 94.149 ± 0.004°
• γ: 90°
• Cell volume: 5887 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0806
• Residual factor for significantly intense reflections: 0.0633
• Weighted residual factors for significantly intense reflections: 0.1568
• Weighted residual factors for all reflections included in the refinement: 0.1692
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No