Information card for entry 4336052

Structure parameters

• Formula: B14 Ba2 H16 K4 O33
• Calculated formula: B14 Ba2 H16 K4 O33
• Title of publication: Three New Mixed-Alkali- and Alkaline-Earth-Metal Borates: From 1D Chain to 2D Layer to 3D Framework
• Authors of publication: Han-Qing Wu; Ping Ju; Huan He; Bai-Feng Yang; Guo-Yu Yang
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 10566 - 10570
• a: 9.0768 ± 0.0003 Å
• b: 12.922 ± 0.0008 Å
• c: 13.3452 ± 0.0009 Å
• α: 106.889 ± 0.006°
• β: 95.075 ± 0.004°
• γ: 105.89 ± 0.004°
• Cell volume: 1416.32 ± 0.15 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0308
• Residual factor for significantly intense reflections: 0.0231
• Weighted residual factors for significantly intense reflections: 0.0528
• Weighted residual factors for all reflections included in the refinement: 0.0554
• 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: No
• Has Fobs: No