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Information card for entry 1574893
Preview
| Coordinates | 1574893.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C4 H4 Br Cl3 F39 O12 S3 Sb Te6 |
|---|---|
| Calculated formula | C4 H4 Br Cl3 F39 O12 S3 Sb Te6 |
| Title of publication | On the Synthesis and Structure of Reactive Halonium Ions |
| Authors of publication | Fischer, Lukas; Lee, Michael H.; Wiesner, Anja; Muller, Carsten; Riedel, Sebastian |
| Journal of publication | Chemical Science |
| Year of publication | 2025 |
| a | 9.8994 ± 0.0007 Å |
| b | 10.0636 ± 0.0007 Å |
| c | 22.7766 ± 0.0017 Å |
| α | 93.244 ± 0.003° |
| β | 100.968 ± 0.003° |
| γ | 95.729 ± 0.003° |
| Cell volume | 2209.9 ± 0.3 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 9 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0364 |
| Residual factor for significantly intense reflections | 0.0289 |
| Weighted residual factors for significantly intense reflections | 0.0549 |
| Weighted residual factors for all reflections included in the refinement | 0.0569 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.136 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300138 (current) | 2025-06-20 | cif/ Adding structures of 1574893, 1574894, 1574895, 1574896 via cif-deposit CGI script. |
1574893.cif |
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Users of the data should acknowledge the original authors of the
structural data.