Information card for entry 4134275

Structure parameters

• Formula: C5 H9 F I3 N Pb
• Calculated formula: C5 H9 F I3 N Pb
• Title of publication: Observation of vortex domains in a two-dimensional lead iodide perovskite ferroelectric.
• Authors of publication: Zhang, Han-Yue; Song, Xian-Jiang; Chen, Xiao-Gang; Zhang, Zhi-Xu; You, Yu-Meng; Tang, Yuan-Yuan; Xiong, Ren-Gen
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2020
• a: 8.7441 ± 0.0014 Å
• b: 19.056 ± 0.003 Å
• c: 8.0199 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1336.3 ± 0.3 ų
• Cell temperature: 403 ± 2 K
• Ambient diffraction temperature: 403 ± 2 K
• Number of distinct elements: 6
• 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: 0.1304
• Residual factor for significantly intense reflections: 0.1049
• Weighted residual factors for significantly intense reflections: 0.2548
• Weighted residual factors for all reflections included in the refinement: 0.2796
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No