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Information card for entry 1573798
Preview
| Coordinates | 1573798.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H19 F2 N O2 |
|---|---|
| Calculated formula | C21 H19 F2 N O2 |
| Title of publication | One-pot Nazarov cyclization/oxidative 1,2-carbon rearrangement/Ritter reaction to access 5-quaternary-4-amidocyclopent-2-enones and 2-quaternary-3-amidoindanones. |
| Authors of publication | Hu, Yue-Hong; Chen, Yu-Ting; He, Zhi-Juan; Gan, Zhang-Yan; Zhang, Ling-Hui; Xi, Wen-Jie; Li, Baosheng; Zhang, Fu-Min |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2025 |
| Journal volume | 61 |
| Journal issue | 18 |
| Pages of publication | 3720 - 3723 |
| a | 9.7705 ± 0.0002 Å |
| b | 13.1781 ± 0.0003 Å |
| c | 14.487 ± 0.0004 Å |
| α | 90° |
| β | 103.85 ± 0.002° |
| γ | 90° |
| Cell volume | 1811.07 ± 0.08 Å3 |
| Cell temperature | 271.8 ± 0.9 K |
| Ambient diffraction temperature | 271.8 ± 0.9 K |
| Number of distinct elements | 5 |
| Space group number | 9 |
| Hermann-Mauguin space group symbol | I 1 a 1 |
| Hall space group symbol | I -2ya |
| Residual factor for all reflections | 0.0406 |
| Residual factor for significantly intense reflections | 0.0372 |
| Weighted residual factors for significantly intense reflections | 0.1048 |
| Weighted residual factors for all reflections included in the refinement | 0.1082 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.103 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 298065 (current) | 2025-03-04 | cif/ Updating files of 1573796, 1573797, 1573798, 1573799, 1573800 Original log message: Adding full bibliography for 1573796--1573800.cif. |
1573798.cif |
| 297526 | 2025-01-30 | cif/ Adding structures of 1573796, 1573797, 1573798, 1573799, 1573800 via cif-deposit CGI script. |
1573798.cif |
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Users of the data should acknowledge the original authors of the
structural data.