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Information card for entry 2022944
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| Coordinates | 2022944.cif |
|---|---|
| Structure factors | 2022944.hkl |
| Original IUCr paper | HTML |
| Chemical name | Bis[μ-2-(1<i>H</i>-1,3-benzodiazol-2-yl)phenolato]bis[ethanol(thiocyanato)cobalt(II)] |
|---|---|
| Formula | C32 H30 Co2 N6 O4 S2 |
| Calculated formula | C32 H30 Co2 N6 O4 S2 |
| Title of publication | Synthesis and crystal structures of two related Co and Mn complexes: a celebration of collaboration between the universities of Dakar and Southampton |
| Authors of publication | Orton, James B.; Diouf, Ngone; Gueye, Rokhaya S.; Gaye, Mohamed; Thiam, Ibrahima Elhadji; Coles, Simon J. |
| Journal of publication | Acta Crystallographica Section E Crystallographic Communications |
| Year of publication | 2023 |
| Journal volume | 79 |
| Journal issue | 12 |
| Pages of publication | 1109 - 1114 |
| a | 7.74843 ± 0.0001 Å |
| b | 19.2895 ± 0.0003 Å |
| c | 10.69753 ± 0.00011 Å |
| α | 90° |
| β | 93.3777 ± 0.001° |
| γ | 90° |
| Cell volume | 1596.11 ± 0.04 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0301 |
| Residual factor for significantly intense reflections | 0.0286 |
| Weighted residual factors for significantly intense reflections | 0.0784 |
| Weighted residual factors for all reflections included in the refinement | 0.0793 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.083 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 288936 (current) | 2024-01-07 | cif/ Updating files of 2022944 Original log message: Adding full bibliography for 2022944.cif. |
2022944.cif 2022944.hkl |
| 287666 | 2023-11-17 | cif/ hkl/ Adding structures of 2022944 via cif-deposit CGI script. |
2022944.cif 2022944.hkl |
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Users of the data should acknowledge the original authors of the
structural data.