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Information card for entry 7721139
Preview
| Coordinates | 7721139.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Cl6 O7 S2 Se2 |
|---|---|
| Calculated formula | Cl6 O7 S2 Se2 |
| 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 | 12.0088 ± 0.0004 Å |
| b | 18.3082 ± 0.0007 Å |
| c | 8.9012 ± 0.0003 Å |
| α | 90° |
| β | 132.218 ± 0.001° |
| γ | 90° |
| Cell volume | 1449.35 ± 0.09 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 4 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0214 |
| Residual factor for significantly intense reflections | 0.0156 |
| Weighted residual factors for significantly intense reflections | 0.0318 |
| Weighted residual factors for all reflections included in the refinement | 0.0331 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.0072 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 306580 (current) | 2026-06-16 | cif/ Adding structures of 7721136, 7721137, 7721138, 7721139 via cif-deposit CGI script. |
7721139.cif |
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Users of the data should acknowledge the original authors of the
structural data.