Information card for entry 2108873

Structure parameters

• Chemical name: <i>catena</i>-Poly[<i>N</i>,<i>N</i>-dimethylethane-1,2-diammonium [[tetrachloridobismuthate(III)]-μ-chlorido]]
• Formula: C4 H14 Bi Cl5 N2
• Calculated formula: C4 H14 Bi Cl5 N2
• Title of publication: Understanding distortions of inorganic substructures in chloridobismuthates(III)
• Authors of publication: Bujak, Maciej
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2021
• Journal volume: 77
• Journal issue: 5
• a: 7.60312 ± 0.00009 Å
• b: 12.50404 ± 0.00014 Å
• c: 13.63023 ± 0.00015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1295.82 ± 0.03 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0104
• Residual factor for significantly intense reflections: 0.01
• Weighted residual factors for significantly intense reflections: 0.0236
• Weighted residual factors for all reflections included in the refinement: 0.0237
• Goodness-of-fit parameter for all reflections included in the refinement: 1.143
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes