Information card for entry 4130328

Structure parameters

• Formula: C48 H65 B2 K O2
• Calculated formula: C48 H65 B2 K O2
• Title of publication: Forming B-B Bonds by the Controlled Reduction of a Tetraaryl-diborane(6).
• Authors of publication: Kaese, Thomas; Hübner, Alexander; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2016
• Journal volume: 138
• Journal issue: 19
• Pages of publication: 6224 - 6233
• a: 13.6225 ± 0.001 Å
• b: 16.3106 ± 0.0008 Å
• c: 19.6114 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4357.5 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.078
• Residual factor for significantly intense reflections: 0.0668
• Weighted residual factors for significantly intense reflections: 0.182
• Weighted residual factors for all reflections included in the refinement: 0.1907
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No