Information card for entry 7045946

Structure parameters

• Formula: C11.12 H22.24 B2 O4
• Calculated formula: C11.1165 H22.233 B2 O4
• Title of publication: Unsymmetrical diborane(4) derivatives by copper mediated B-B coupling.
• Authors of publication: Oschmann, W.; Borner, C.; Kleeberg, C.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 15
• Pages of publication: 5318 - 5327
• a: 20.4494 ± 0.0014 Å
• b: 11.6284 ± 0.0008 Å
• c: 11.6718 ± 0.0008 Å
• α: 90°
• β: 92.161 ± 0.006°
• γ: 90°
• Cell volume: 2773.5 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0857
• Residual factor for significantly intense reflections: 0.0543
• Weighted residual factors for significantly intense reflections: 0.1365
• Weighted residual factors for all reflections included in the refinement: 0.1483
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No