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Information card for entry 1572431
Preview
| Coordinates | 1572431.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C43 H56 O3 W |
|---|---|
| Calculated formula | C43 O3 W |
| Title of publication | Snapshot of cyclooctyne ring-opening to a tethered alkylidene cyclic polymer catalyst. |
| Authors of publication | Hurst, Javier M.; Yadav, Rinku; Boeck, Parker T.; Ghiviriga, Ion; Brantley, ChristiAnna L; Dobrzycki, Łukasz; Veige, Adam S. |
| Journal of publication | Chemical science |
| Year of publication | 2024 |
| Journal volume | 15 |
| Journal issue | 38 |
| Pages of publication | 15873 - 15879 |
| a | 10.8411 ± 0.0003 Å |
| b | 16.8936 ± 0.0005 Å |
| c | 20.2912 ± 0.0005 Å |
| α | 90° |
| β | 99.748 ± 0.001° |
| γ | 90° |
| Cell volume | 3662.58 ± 0.17 Å3 |
| Cell temperature | 100 ± 1 K |
| Ambient diffraction temperature | 100 ± 1 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0347 |
| Residual factor for significantly intense reflections | 0.0304 |
| Weighted residual factors for significantly intense reflections | 0.0646 |
| Weighted residual factors for all reflections included in the refinement | 0.0661 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.142 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 295212 (current) | 2024-10-06 | cif/ Updating files of 1572430, 1572431, 1572432 Original log message: Adding full bibliography for 1572430--1572432.cif. |
1572431.cif |
| 294299 | 2024-08-31 | cif/ Adding structures of 1572430, 1572431, 1572432 via cif-deposit CGI script. |
1572431.cif |
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Users of the data should acknowledge the original authors of the
structural data.