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Information card for entry 2021457
Preview
| Coordinates | 2021457.cif |
|---|---|
| Structure factors | 2021457.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[[μ-1,3-bis(2-methyl-1<i>H</i>-imidazol-1-yl)benzene](μ-5-nitrobenzene-1,3-dicarboxylato)zinc(II)] |
|---|---|
| Formula | C22 H17 N5 O6 Zn |
| Calculated formula | C22 H17 N5 O6 Zn |
| Title of publication | A new two-dimensional Zn^II^ coordination polymer based on 1,3-bis(2-methyl-1<i>H</i>-imidazol-1-yl)benzene and 5-nitrobenzene-1,3-dicarboxylic acid: synthesis, crystal structure and physical properties |
| Authors of publication | Chen, Ning-Ning; Ni, Jian-Ning; Wang, Jun; Tao, Jian-Qing |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2019 |
| Journal volume | 75 |
| Journal issue | 2 |
| Pages of publication | 196 - 199 |
| a | 12.568 ± 0.006 Å |
| b | 13.324 ± 0.007 Å |
| c | 14.207 ± 0.007 Å |
| α | 90° |
| β | 110.912 ± 0.005° |
| γ | 90° |
| Cell volume | 2222.3 ± 1.9 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 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 | 0.0292 |
| Residual factor for significantly intense reflections | 0.0265 |
| Weighted residual factors for significantly intense reflections | 0.0736 |
| Weighted residual factors for all reflections included in the refinement | 0.0751 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.066 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 213936 (current) | 2019-03-03 | cif/ Updating files of 2021457 Original log message: Adding full bibliography for 2021457.cif. |
2021457.cif 2021457.hkl |
| 213385 | 2019-01-30 | cif/ hkl/ Adding structures of 2021457 via cif-deposit CGI script. |
2021457.cif 2021457.hkl |
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Users of the data should acknowledge the original authors of the
structural data.