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Information card for entry 2022934
Preview
| Coordinates | 2022934.cif |
|---|---|
| Structure factors | 2022934.hkl |
| Original IUCr paper | HTML |
| Chemical name | [Bis(pyridin-2-yl-κ<i>N</i>)amine](formato-κ<i>O</i>)(<i>m</i>-hydroxybenzoato-κ^2^<i>O</i>,<i>O</i>')copper(II) |
|---|---|
| Formula | C18 H15 Cu N3 O5 |
| Calculated formula | C18 H15 Cu N3 O5 |
| Title of publication | Crystal structure and Hirshfeld surface analysis of a new mononuclear copper(II) complex: [bis(pyridin-2-yl-κN)amine](formato-κO)(m-hydroxybenzoato-κ2 O,O′)copper(II) |
| Authors of publication | Chaisuriya, Wanassanan; Chainok, Kittipong; Wannarit, Nanthawat |
| Journal of publication | Acta Crystallographica Section E Crystallographic Communications |
| Year of publication | 2023 |
| Journal volume | 79 |
| Journal issue | 12 |
| Pages of publication | 1115 - 1120 |
| a | 8.3265 ± 0.0003 Å |
| b | 14.9699 ± 0.0005 Å |
| c | 13.9523 ± 0.0004 Å |
| α | 90° |
| β | 99.242 ± 0.001° |
| γ | 90° |
| Cell volume | 1716.53 ± 0.1 Å3 |
| Cell temperature | 296.15 K |
| Ambient diffraction temperature | 296.15 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 | 0.0891 |
| Residual factor for significantly intense reflections | 0.0455 |
| Weighted residual factors for significantly intense reflections | 0.096 |
| Weighted residual factors for all reflections included in the refinement | 0.1148 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.012 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 288937 (current) | 2024-01-07 | cif/ Updating files of 2022934 Original log message: Adding full bibliography for 2022934.cif. |
2022934.cif 2022934.hkl |
| 287247 | 2023-11-03 | cif/ hkl/ Adding structures of 2022934 via cif-deposit CGI script. |
2022934.cif 2022934.hkl |
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Users of the data should acknowledge the original authors of the
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