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Information card for entry 7160525
Preview
| Coordinates | 7160525.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H16 F N3 O3 |
|---|---|
| Calculated formula | C18 H16 F N3 O3 |
| Title of publication | Direct C-H Fluorination/Heteroarylation of Oxindoles with Quinoxalin-2(1H)-ones Using Selectfluor |
| Authors of publication | Qin, Hui; Wei, Guoliang; Xie, Wen-Geng; Mao, Xiaohong; Wang, Fu-Wei; Bao, Meihua; Zheng, Xiaowei; Zhang, Yiwen; Huang, Ping |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 24.355 ± 0.017 Å |
| b | 8.37 ± 0.006 Å |
| c | 15.766 ± 0.012 Å |
| α | 90° |
| β | 100.14 ± 0.02° |
| γ | 90° |
| Cell volume | 3164 ± 4 Å3 |
| Cell temperature | 193 K |
| Ambient diffraction temperature | 193 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.1329 |
| Residual factor for significantly intense reflections | 0.0885 |
| Weighted residual factors for significantly intense reflections | 0.2547 |
| Weighted residual factors for all reflections included in the refinement | 0.2953 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.34139 Å |
| Diffraction radiation type | GaKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 299484 (current) | 2025-05-02 | cif/ Adding structures of 7160525 via cif-deposit CGI script. |
7160525.cif |
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Users of the data should acknowledge the original authors of the
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