Information card for entry 4319235

Structure parameters

• Formula: C16 Bi7 Cu I19 O12
• Calculated formula: C16 Bi7 Cu1.042 I19 O12
• Title of publication: CuBi7I19(C4H8O3H)3(C4H8O3H2), a Novel Complex Bismuth Iodide Containing One-Dimensional [CuBi5I19]3-Chains
• Authors of publication: Claus Feldmann
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 818 - 819
• a: 16.1379 ± 0.0006 Å
• b: 18.6602 ± 0.0007 Å
• c: 26.8098 ± 0.001 Å
• α: 90°
• β: 95.688 ± 0.001°
• γ: 90°
• Cell volume: 8033.7 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1069
• Residual factor for significantly intense reflections: 0.0543
• Weighted residual factors for significantly intense reflections: 0.1576
• Weighted residual factors for all reflections included in the refinement: 0.1827
• Goodness-of-fit parameter for all reflections included in the refinement: 0.939
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No