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Information card for entry 2206916
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| Coordinates | 2206916.cif |
|---|---|
| Structure factors | 2206916.hkl |
| Original IUCr paper | HTML |
| Formula | C15 H15 Cl3 N4 Zn |
|---|---|
| Calculated formula | C15 H15 Cl3 N4 Zn |
| SMILES | [Zn](Cl)(Cl)(Cl)[n]1c(Cn2c[n+](cc2)Cc2ncccc2)cccc1 |
| Title of publication | Trichloro[1,3-bis(2-pyridylmethyl)imidazolium]zinc(II) |
| Authors of publication | Wan, Xiang-Jian; Xu, Feng-Bo; Li, Qing-Shan; Song, Hai-Bin; Zhang, Zheng-Zhi |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2005 |
| Journal volume | 61 |
| Journal issue | 10 |
| Pages of publication | m2174 - m2175 |
| a | 8.3222 ± 0.0012 Å |
| b | 13.3871 ± 0.0018 Å |
| c | 15.977 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1780 ± 0.4 Å3 |
| Cell temperature | 294 ± 2 K |
| Ambient diffraction temperature | 294 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0668 |
| Residual factor for significantly intense reflections | 0.0366 |
| Weighted residual factors for significantly intense reflections | 0.0551 |
| Weighted residual factors for all reflections included in the refinement | 0.0623 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.985 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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