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Information card for entry 7711830
Preview
| Coordinates | 7711830.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H58 P2 S |
|---|---|
| Calculated formula | C36 H58 P2 S |
| Title of publication | Deoxygenation of chalcogen oxides EO2 (E = S, Se) with phospha-Wittig reagents |
| Authors of publication | Dankert, Fabian; Gupta, Priyanka; Wellnitz, Tim; Baumann, Wolfgang; Hering-Junghans, Christian |
| Journal of publication | Dalton Transactions |
| Year of publication | 2022 |
| a | 18.4987 ± 0.0011 Å |
| b | 9.3637 ± 0.0006 Å |
| c | 20.6165 ± 0.001 Å |
| α | 90° |
| β | 102.173 ± 0.004° |
| γ | 90° |
| Cell volume | 3490.8 ± 0.4 Å3 |
| Cell temperature | 150.01 K |
| Ambient diffraction temperature | 150.01 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 | 0.0572 |
| Residual factor for significantly intense reflections | 0.0428 |
| Weighted residual factors for significantly intense reflections | 0.1033 |
| Weighted residual factors for all reflections included in the refinement | 0.1132 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 279519 (current) | 2022-11-24 | cif/ Adding structures of 7711830, 7711831, 7711832, 7711833, 7711834, 7711835, 7711836 via cif-deposit CGI script. |
7711830.cif |
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Users of the data should acknowledge the original authors of the
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