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Information card for entry 1567406
Preview
| Coordinates | 1567406.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C9 H13 Br4 N3 Pb |
|---|---|
| Calculated formula | C8.9999 H12.9993 Br4 N2.9999 Pb |
| Title of publication | Reliably obtaining white light from layered halide perovskites at room temperature |
| Authors of publication | Crace, Ethan; Su, Alexander; Karunadasa, Hemamala I. |
| Journal of publication | Chemical Science |
| Year of publication | 2022 |
| a | 11.9594 ± 0.0005 Å |
| b | 30.9963 ± 0.0017 Å |
| c | 8.6387 ± 0.0005 Å |
| α | 90° |
| β | 94.186 ± 0.001° |
| γ | 90° |
| Cell volume | 3193.8 ± 0.3 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100.15 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0681 |
| Residual factor for significantly intense reflections | 0.0634 |
| Weighted residual factors for significantly intense reflections | 0.1433 |
| Weighted residual factors for all reflections included in the refinement | 0.1454 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.247 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 277025 (current) | 2022-08-02 | cif/ Adding structures of 1567406, 1567407, 1567408, 1567409, 1567410, 1567411, 1567412, 1567413 via cif-deposit CGI script. |
1567406.cif |
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Users of the data should acknowledge the original authors of the
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