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Information card for entry 7706198
Preview
| Coordinates | 7706198.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C16 H18 Br2 Fe N6 O4 Pd |
|---|---|
| Calculated formula | C16 H18 Br2 Fe N6 O4 Pd |
| Title of publication | Thermal hysteresis induced by external pressure in a 3D Hofmann-type SCO-MOF. |
| Authors of publication | Li, Yue; Kong, Qing-Rong; Guo, Ying; Tang, Zheng |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2021 |
| Journal volume | 50 |
| Journal issue | 4 |
| Pages of publication | 1384 - 1389 |
| a | 7.2533 ± 0.0005 Å |
| b | 7.2533 ± 0.0005 Å |
| c | 13.346 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 702.14 ± 0.13 Å3 |
| Cell temperature | 99.9 ± 0.5 K |
| Ambient diffraction temperature | 99.9 ± 0.5 K |
| Number of distinct elements | 7 |
| Space group number | 83 |
| Hermann-Mauguin space group symbol | P 4/m |
| Hall space group symbol | -P 4 |
| Residual factor for all reflections | 0.1061 |
| Residual factor for significantly intense reflections | 0.0815 |
| Weighted residual factors for significantly intense reflections | 0.2282 |
| Weighted residual factors for all reflections included in the refinement | 0.2448 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.121 |
| 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 |
|---|---|---|---|
| 261653 (current) | 2021-02-05 | cif/ Updating files of 7706197, 7706198, 7706199, 7706200 Original log message: Adding full bibliography for 7706197--7706200.cif. |
7706198.cif |
| 260135 | 2020-12-24 | cif/ Adding structures of 7706197, 7706198, 7706199, 7706200 via cif-deposit CGI script. |
7706198.cif |
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Users of the data should acknowledge the original authors of the
structural data.