Information card for entry 7114687

Structure parameters

• Formula: C20 H27 B8 P
• Calculated formula: C20 H27 B8 P
• Title of publication: Monocarbaborane chemistry. Preparation and characterisation of [4-CB8H9]‒, the ‘missing’ closo-carbaborane anion
• Authors of publication: Jelínek, Tomáš; Kilner, Colin A.; Thornton-Pett, Mark; Kennedy, John D.; Štíbr, Bohumil; Schanz, Hans-Jörg; Wrackmeyer, Bernd; Holub, Josef; Bakardjiev, Mario; Hnyk, Drahomír; Ormsby, Daniel L.
• Journal of publication: Chemical Communications
• Year of publication: 2001
• Journal issue: 18
• Pages of publication: 1756
• a: 14.7338 ± 0.0002 Å
• b: 14.1571 ± 0.0003 Å
• c: 22.7377 ± 0.0004 Å
• α: 90°
• β: 107.784 ± 0.001°
• γ: 90°
• Cell volume: 4516.17 ± 0.14 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.0752
• Residual factor for significantly intense reflections: 0.0549
• Weighted residual factors for significantly intense reflections: 0.1332
• Weighted residual factors for all reflections included in the refinement: 0.1491
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No