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Information card for entry 2200725
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| Coordinates | 2200725.cif |
|---|---|
| Structure factors | 2200725.hkl |
| Original IUCr paper | HTML |
| Chemical name | Quinolinium trichloroquinoline-zinc(II) |
|---|---|
| Formula | C18 H15 Cl3 N2 Zn |
| Calculated formula | C18 H15 Cl3 N2 Zn |
| SMILES | [Zn](Cl)(Cl)(Cl)[n]1cccc2ccccc12.c1ccc2ccccc2[nH+]1 |
| Title of publication | Quinolinium trichloro(quinoline)zinc(II) |
| Authors of publication | Wang, Wenguo; Zhang, Xiaofeng; Huang, Deguang; Zhu, Hongping; Chen, Changneng; Liu, Qiutian |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2001 |
| Journal volume | 57 |
| Journal issue | 12 |
| Pages of publication | m561 - m563 |
| a | 8.236 ± 0.0007 Å |
| b | 9.5392 ± 0.0007 Å |
| c | 11.9512 ± 0.001 Å |
| α | 98.499 ± 0.001° |
| β | 94.67 ± 0.001° |
| γ | 106.104 ± 0.001° |
| Cell volume | 884.76 ± 0.12 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0708 |
| Residual factor for significantly intense reflections | 0.0453 |
| Weighted residual factors for all reflections included in the refinement | 0.1467 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.913 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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