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Information card for entry 2021564
Preview
| Coordinates | 2021564.cif |
|---|---|
| Structure factors | 2021564.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[[{μ~2~-bis[4-(2-methyl-1<i>H</i>-imidazol-1-yl)phenyl] ether-κ^2^<i>N</i>^3^:<i>N</i>^3'^}(μ~2~-furan-2,5-dicarboxylato-κ^2^<i>O</i>^2^:<i>O</i>^5^)zinc(II)] 1.76-hydrate] |
|---|---|
| Formula | C26 H23.52 N4 O7.76 Zn |
| Calculated formula | C26 H23.52 N4 O7.76 Zn |
| Title of publication | A fourfold interpenetrating diamond-like three-dimensional zinc(II) coordination polymer: synthesis, crystal structure and physical properties |
| Authors of publication | Chen, Hui-Ru |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2019 |
| Journal volume | 75 |
| Journal issue | 5 |
| Pages of publication | 504 - 507 |
| a | 11.622 ± 0.005 Å |
| b | 12.346 ± 0.006 Å |
| c | 18.669 ± 0.009 Å |
| α | 90° |
| β | 92.13 ± 0.03° |
| γ | 90° |
| Cell volume | 2677 ± 2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0337 |
| Residual factor for significantly intense reflections | 0.0285 |
| Weighted residual factors for significantly intense reflections | 0.0768 |
| Weighted residual factors for all reflections included in the refinement | 0.079 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 215662 (current) | 2019-06-03 | cif/ Updating files of 2021564 Original log message: Adding full bibliography for 2021564.cif. |
2021564.cif 2021564.hkl |
| 214562 | 2019-04-09 | cif/ hkl/ Adding structures of 2021564 via cif-deposit CGI script. |
2021564.cif 2021564.hkl |
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Users of the data should acknowledge the original authors of the
structural data.