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Information card for entry 2022275
Preview
| Coordinates | 2022275.cif |
|---|---|
| Structure factors | 2022275.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[[[μ-bis(pyridin-4-yl)amine-κ^2^<i>N</i>:<i>N</i>'](μ-naphthalene-2,6-dicarboxylato-κ^2^<i>O</i>^2^:<i>O</i>^6^)zinc(II)] 0.5-hydrate] |
|---|---|
| Formula | C22 H16 N3 O4.5 Zn |
| Calculated formula | C22 H16 N3 O4.5 Zn |
| Title of publication | Assembly of two novel coordination polymers by selecting ditopic or chelating auxiliary ligands with naphthalene-2,6-dicarboxylic acid: synthesis, structure and luminescence sensing |
| Authors of publication | Zuo, Yuxiang; Yang, Jie; Chen, Cheng; Xue, Yun-Shan; Zhang, Jun |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2020 |
| Journal volume | 76 |
| Journal issue | 12 |
| a | 11.0556 ± 0.001 Å |
| b | 9.5218 ± 0.0009 Å |
| c | 18.2923 ± 0.0017 Å |
| α | 90° |
| β | 100.732 ± 0.003° |
| γ | 90° |
| Cell volume | 1891.9 ± 0.3 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298.42 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 | 0.0306 |
| Residual factor for significantly intense reflections | 0.0252 |
| Weighted residual factors for significantly intense reflections | 0.0608 |
| Weighted residual factors for all reflections included in the refinement | 0.0629 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.079 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 259241 (current) | 2020-11-25 | cif/ hkl/ Adding structures of 2022275, 2022276 via cif-deposit CGI script. |
2022275.cif 2022275.hkl |
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Users of the data should acknowledge the original authors of the
structural data.