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Information card for entry 2023267
Preview
| Coordinates | 2023267.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | C20 H46 Au2 Br4 P2 S2 |
|---|---|
| Calculated formula | C20 H46 Au2 Br4 P2 S2 |
| Title of publication | Crystal structures of seven mixed-valence gold compounds of the form [(R 1 R 2 R 3PE)2AuI]+[AuIII X 4]− (R = tert-butyl or isopropyl, E = S or Se, and X = Cl or Br) |
| Authors of publication | Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza |
| Journal of publication | Acta Crystallographica Section E Crystallographic Communications |
| Year of publication | 2024 |
| Journal volume | 80 |
| Journal issue | 10 |
| Pages of publication | 1087 - 1096 |
| a | 13.7871 ± 0.0004 Å |
| b | 10.4042 ± 0.0003 Å |
| c | 22.724 ± 0.0006 Å |
| α | 90° |
| β | 93.035 ± 0.003° |
| γ | 90° |
| Cell volume | 3255.04 ± 0.16 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 | 0.0601 |
| Residual factor for significantly intense reflections | 0.0459 |
| Weighted residual factors for significantly intense reflections | 0.1032 |
| Weighted residual factors for all reflections included in the refinement | 0.1117 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.015 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 294951 (current) | 2024-10-01 | cif/ Adding structures of 2023264, 2023265, 2023266, 2023267, 2023268, 2023269, 2023270 via cif-deposit CGI script. |
2023267.cif |
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Users of the data should acknowledge the original authors of the
structural data.