Information card for entry 7045944

Structure parameters

• Formula: C11.17 H22.33 B2 O4
• Calculated formula: C11.1655 H22.331 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: 20.2409 ± 0.001 Å
• b: 11.7717 ± 0.0004 Å
• c: 11.6993 ± 0.0004 Å
• α: 90°
• β: 92.725 ± 0.003°
• γ: 90°
• Cell volume: 2784.44 ± 0.19 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: 0.0802
• Residual factor for significantly intense reflections: 0.069
• Weighted residual factors for significantly intense reflections: 0.1783
• Weighted residual factors for all reflections included in the refinement: 0.1852
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No