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Information card for entry 7245814
Preview
| Coordinates | 7245814.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C24 H34 N3 O11 Pr |
|---|---|
| Calculated formula | C24 H34 N3 O11 Pr |
| Title of publication | A reversible pressure-induced bond rearrangement of flexible lanthanide 2,5-bis(allyloxy)terephthalate coordination polymer networks |
| Authors of publication | Hunter, L. R.; Sellars, J. D.; Probert, M. R. |
| Journal of publication | CrystEngComm |
| Year of publication | 2022 |
| a | 9.8826 ± 0.0009 Å |
| b | 11.1554 ± 0.001 Å |
| c | 13.9347 ± 0.0012 Å |
| α | 109.747 ± 0.003° |
| β | 95.52 ± 0.002° |
| γ | 96.847 ± 0.002° |
| Cell volume | 1420.2 ± 0.2 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0307 |
| Residual factor for significantly intense reflections | 0.0306 |
| Weighted residual factors for significantly intense reflections | 0.0818 |
| Weighted residual factors for all reflections included in the refinement | 0.0819 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 279272 (current) | 2022-11-15 | cif/ Adding structures of 7245814, 7245815, 7245816, 7245817, 7245818, 7245819, 7245820, 7245821, 7245822, 7245823, 7245824, 7245825 via cif-deposit CGI script. |
7245814.cif |
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Users of the data should acknowledge the original authors of the
structural data.