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Information card for entry 7160880
Preview
| Coordinates | 7160880.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H22 N2 O9 |
|---|---|
| Calculated formula | C21 H22 N2 O9 |
| Title of publication | Stereoselective synthesis of functionalized perhydropyrrolo[1,2-b]isoxazoles based on (3+2)-annulation of donor-acceptor cyclopropanes and isoxazolines |
| Authors of publication | Potapov, Konstantin V.; Novikov, Maxim A.; Kozmenko, Yaroslav V.; Solyev, Pavel N.; Volodin, Alexander D.; Korlyukov, Alexander; Novikov, Roman A.; Tomilov, Yury |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 8.598 ± 0.006 Å |
| b | 10.18 ± 0.006 Å |
| c | 12.966 ± 0.012 Å |
| α | 71.3 ± 0.03° |
| β | 80.52 ± 0.03° |
| γ | 76.2 ± 0.03° |
| Cell volume | 1039.1 ± 1.4 Å3 |
| Cell temperature | 120 K |
| Ambient diffraction temperature | 120 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.104 |
| Residual factor for significantly intense reflections | 0.058 |
| Weighted residual factors for significantly intense reflections | 0.1372 |
| Weighted residual factors for all reflections included in the refinement | 0.1544 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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The link is: https://www.crystallography.net/7160880.html
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