Information card for entry 4349729

Structure parameters

• Formula: C4 H16 Bi Cl5 N2
• Calculated formula: C4 H16 Bi Cl5 N2
• Title of publication: Ferroelectricity in bis(ethylammonium) pentachlorobismuthate(iii): synthesis, structure, polar and spectroscopic properties
• Authors of publication: Piecha-Bisiorek, Anna; Gągor, Anna; Jakubas, Ryszard; Ciżman, Agnieszka; Janicki, Rafał; Medycki, Wojciech
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2017
• Journal volume: 4
• Journal issue: 8
• Pages of publication: 1281
• a: 17.8318 ± 0.0002 Å
• b: 21.9673 ± 0.0008 Å
• c: 7.5656 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2963.57 ± 0.19 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 64
• Hermann-Mauguin space group symbol: A e a m
• Hall space group symbol: -A 2 2ab
• Residual factor for all reflections: 0.0349
• Residual factor for significantly intense reflections: 0.0271
• Weighted residual factors for significantly intense reflections: 0.0652
• Weighted residual factors for all reflections included in the refinement: 0.0686
• Goodness-of-fit parameter for all reflections included in the refinement: 1.117
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No