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Information card for entry 7721136
Preview
| Coordinates | 7721136.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Cl4 O3 S Se |
|---|---|
| Calculated formula | Cl4 O3 S Se |
| Title of publication | Chalcogen Bonding vs. Weakly Coordinating Anions – A Solid State Study on Halidoselenium Cations in an Oxoanionic Environment |
| Authors of publication | Langwald, Jan; Burguera Piña, Sergi; Frontera, Antonio; Wickleder, Mathias Siegfried |
| Journal of publication | Dalton Transactions |
| Year of publication | 2026 |
| a | 9.196 ± 0.0004 Å |
| b | 9.5899 ± 0.0003 Å |
| c | 18.7926 ± 0.0008 Å |
| α | 100.66 ± 0.002° |
| β | 97.718 ± 0.002° |
| γ | 102.121 ± 0.001° |
| Cell volume | 1566.32 ± 0.11 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0541 |
| Residual factor for significantly intense reflections | 0.0404 |
| Weighted residual factors for significantly intense reflections | 0.0874 |
| Weighted residual factors for all reflections included in the refinement | 0.0935 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.06 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.