Information card for entry 4337482

Structure parameters

• Formula: Bi9 Cl5 Mn0.821 O12 Pb0.179
• Calculated formula: Bi9 Cl4.9999 Mn0.8 O12 Pb0.2
• Title of publication: Multidimensional open-frameworks: combinations of one-dimensional channels and two-dimensional layers in novel BI/M oxo-chlorides.
• Authors of publication: Lü, Minfeng; Aliev, Almaz; Olchowka, Jacob; Colmont, Marie; Huvé, Marielle; Wickleder, Claudia; Mentré, Olivier
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 1
• Pages of publication: 528 - 536
• a: 3.8695 ± 0.0002 Å
• b: 31.737 ± 0.002 Å
• c: 15.7602 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1935.45 ± 0.18 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• Space group number: 63
• Hermann-Mauguin space group symbol: C m c m
• Hall space group symbol: -C 2c 2
• Residual factor for all reflections: 0.0515
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.0652
• Weighted residual factors for all reflections included in the refinement: 0.0668
• Goodness-of-fit parameter for significantly intense reflections: 1.08
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No