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Information card for entry 1577371
Preview
| Coordinates | 1577371.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C59 H74 B F N2 |
|---|---|
| Calculated formula | C59 H74 B F N2 |
| Title of publication | Xanthene-to-fluorene skeletal editing <i>via</i> oxygen deletion mediated by boron and aluminium radicals. |
| Authors of publication | Nahon, Emily; Nelmes, Gareth R.; Dallerba, Elena; Lim, Li Feng; Cox, Nicholas; McMullin, Claire L.; Massi, Massimiliano; Kallmeier, Fabian; Hicks, Jamie |
| Journal of publication | Chemical science |
| Year of publication | 2026 |
| Journal volume | 17 |
| Journal issue | 21 |
| Pages of publication | 10755 - 10761 |
| a | 10.7164 ± 0.0003 Å |
| b | 18.2938 ± 0.0003 Å |
| c | 41.3527 ± 0.0003 Å |
| α | 84.219 ± 0.001° |
| β | 89.865 ± 0.002° |
| γ | 73.44 ± 0.002° |
| Cell volume | 7728.2 ± 0.3 Å3 |
| Cell temperature | 150 ± 0.1 K |
| Ambient diffraction temperature | 150 ± 0.1 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0837 |
| Residual factor for significantly intense reflections | 0.0776 |
| Weighted residual factors for significantly intense reflections | 0.2268 |
| Weighted residual factors for all reflections included in the refinement | 0.2342 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 306203 (current) | 2026-06-04 | cif/ Adding structures of 1577362, 1577363, 1577364, 1577365, 1577366, 1577367, 1577368, 1577369, 1577370, 1577371, 1577372, 1577373 via cif-deposit CGI script. |
1577371.cif |
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Users of the data should acknowledge the original authors of the
structural data.