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Information card for entry 2020519
Preview
| Coordinates | 2020519.cif |
|---|---|
| Structure factors | 2020519.hkl |
| Original IUCr paper | HTML |
| Chemical name | Bis(acetato-κ^2^<i>O</i>,<i>O</i>'){5,6-dimethyl-2-(pyridin-2-yl-κ<i>N</i>)-1-[(pyridin-2-yl)methyl]-1<i>H</i>-benzimidazole-κ<i>N</i>^3^}zinc(II) ethanol monosolvate |
|---|---|
| Formula | C26 H30 N4 O5 Zn |
| Calculated formula | C26 H30 N4 O5 Zn |
| Title of publication | Structural and spectroscopic characterization of two new blue luminescent pyridylbenzimidazole zinc(II) complexes |
| Authors of publication | DeStefano, Matthew R.; Geiger, David K. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2016 |
| Journal volume | 72 |
| Journal issue | 6 |
| a | 16.0866 ± 0.0017 Å |
| b | 8.715 ± 0.0008 Å |
| c | 18.745 ± 0.002 Å |
| α | 90° |
| β | 94.193 ± 0.004° |
| γ | 90° |
| Cell volume | 2620.9 ± 0.5 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0542 |
| Residual factor for significantly intense reflections | 0.036 |
| Weighted residual factors for significantly intense reflections | 0.0823 |
| Weighted residual factors for all reflections included in the refinement | 0.0904 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKa |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 182996 (current) | 2016-05-18 | cif/ hkl/ Adding structures of 2020518, 2020519 via cif-deposit CGI script. |
2020519.cif 2020519.hkl |
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Users of the data should acknowledge the original authors of the
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