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Information card for entry 1577367
Preview
| Coordinates | 1577367.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C112 H142 B2 Br2 Li4 N4 O2 |
|---|---|
| Calculated formula | C112 H142 B2 Br2 Li4 N4 O2 |
| 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 | 21.3971 ± 0.0006 Å |
| b | 36.2939 ± 0.001 Å |
| c | 13.2187 ± 0.0004 Å |
| α | 90° |
| β | 90.469 ± 0.003° |
| γ | 90° |
| Cell volume | 10265.1 ± 0.5 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.1258 |
| Residual factor for significantly intense reflections | 0.1066 |
| Weighted residual factors for significantly intense reflections | 0.2909 |
| Weighted residual factors for all reflections included in the refinement | 0.3123 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.198 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
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