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Information card for entry 2020049
Preview
| Coordinates | 2020049.cif |
|---|---|
| Structure factors | 2020049.hkl |
| Original paper (by DOI) | HTML |
| Chemical name | Poly[[{μ-1-[(1<i>H</i>-benzimidazol-2-yl)methyl]-1<i>H</i>-imidazole-κ^2^<i>N</i>:<i>N</i>'}(μ-5-carboxybenzene-1,3-dicarboxylato-κ^2^<i>O</i>^1^:<i>O</i>^3^)zinc(II)] dimethylformamide monosolvate pentahydrate] |
|---|---|
| Formula | C23 H31 N5 O12 Zn |
| Calculated formula | C23 H31 N5 O12 Zn |
| Title of publication | A new two-dimensional Zn^II^ coordination polymer constructed by a multidentate N-heterocyclic ligand and 5-carboxybenzene-1,3-dicarboxylate |
| Authors of publication | Huang, Qiu-Ying; Yang, Yi; Meng, Xiang-Ru |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 8 |
| a | 10.174 ± 0.002 Å |
| b | 20.843 ± 0.004 Å |
| c | 13.274 ± 0.003 Å |
| α | 90° |
| β | 100.4 ± 0.03° |
| γ | 90° |
| Cell volume | 2768.6 ± 1 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 | 0.0694 |
| Residual factor for significantly intense reflections | 0.0598 |
| Weighted residual factors for significantly intense reflections | 0.1444 |
| Weighted residual factors for all reflections included in the refinement | 0.1517 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.064 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181870 (current) | 2016-04-06 | hkl/2/02/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/02/00 |
2020049.cif 2020049.hkl |
| 152104 | 2015-07-16 | cif/ hkl/ Adding structures of 2020049 via cif-deposit CGI script. |
2020049.cif 2020049.hkl |
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Users of the data should acknowledge the original authors of the
structural data.