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Information card for entry 7249940
Preview
| Coordinates | 7249940.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | 1 |
|---|---|
| Formula | C10 H20 Cl6 Mn2 N2 |
| Calculated formula | C10 H20 Cl6 Mn2 N2 |
| Title of publication | High phase transition temperature and photoluminescence properties in low-dimensional molecular perovskite ferroelastic crystals |
| Authors of publication | Zhang, Jia-Mei; Xu, Zhe-Kun; Qin, Yan; Li, Peng-Fei; Wang, Zhong-Xia |
| Journal of publication | CrystEngComm |
| Year of publication | 2025 |
| Journal volume | 27 |
| Journal issue | 11 |
| Pages of publication | 1534 - 1540 |
| a | 6.3709 ± 0.0003 Å |
| b | 16.9377 ± 0.0009 Å |
| c | 18.33 ± 0.001 Å |
| α | 90° |
| β | 97.538 ± 0.005° |
| γ | 90° |
| Cell volume | 1960.87 ± 0.18 Å3 |
| Cell temperature | 300 ± 0.1 K |
| Ambient diffraction temperature | 300 ± 0.1 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.1 |
| Residual factor for significantly intense reflections | 0.0573 |
| Weighted residual factors for significantly intense reflections | 0.1412 |
| Weighted residual factors for all reflections included in the refinement | 0.1744 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.095 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 298865 (current) | 2025-04-05 | cif/ Updating files of 7249938, 7249939, 7249940, 7249941 Original log message: Adding full bibliography for 7249938--7249941.cif. |
7249940.cif |
| 297709 | 2025-02-13 | cif/ Adding structures of 7249938, 7249939, 7249940, 7249941 via cif-deposit CGI script. |
7249940.cif |
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Users of the data should acknowledge the original authors of the
structural data.