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Information card for entry 4126226
Preview
| Coordinates | 4126226.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C4 H8 Br3 Cd N |
|---|---|
| Calculated formula | C4 H8 Br3 Cd N |
| Title of publication | Unprecedented Ferroelectric-Antiferroelectric-Paraelectric Phase Transitions Discovered in an Organic-Inorganic Hybrid Perovskite. |
| Authors of publication | Li, Peng-Fei; Liao, Wei-Qiang; Tang, Yuan-Yuan; Ye, Heng-Yun; Zhang, Yi; Xiong, Ren-Gen |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2017 |
| a | 7.705 ± 0.005 Å |
| b | 17.658 ± 0.014 Å |
| c | 6.947 ± 0.005 Å |
| α | 90° |
| β | 90.03 ± 0.03° |
| γ | 90° |
| Cell volume | 945.2 ± 1.2 Å3 |
| Cell temperature | 238 ± 2 K |
| Ambient diffraction temperature | 238 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 12 |
| Hermann-Mauguin space group symbol | C 2/m 1 1 |
| Hall space group symbol | -C 2x |
| Residual factor for all reflections | 0.0336 |
| Residual factor for significantly intense reflections | 0.0287 |
| Weighted residual factors for significantly intense reflections | 0.069 |
| Weighted residual factors for all reflections included in the refinement | 0.0705 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.098 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 197859 (current) | 2017-06-16 | cif/ Adding structures of 4126226 via cif-deposit CGI script. |
4126226.cif |
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