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Information card for entry 7129885
Preview
| Coordinates | 7129885.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C22 H14 F3 N O |
|---|---|
| Calculated formula | C22 H14 F3 N O |
| Title of publication | Access to 5-Fluoroalkylated Trisubstituted Oxazoles via Copper-Catalyzed Cyclization of α-Fluoroalkyl-α-diazoketones with Amides |
| Authors of publication | Jiang, Di; Jia, Jingpei; Wang, Baiquan; Li, Bin |
| Journal of publication | Chemical Communications |
| Year of publication | 2022 |
| a | 9.3924 ± 0.0004 Å |
| b | 9.763 ± 0.0004 Å |
| c | 19.6787 ± 0.0007 Å |
| α | 92.407 ± 0.003° |
| β | 98.52 ± 0.003° |
| γ | 108.808 ± 0.004° |
| Cell volume | 1681.51 ± 0.12 Å3 |
| Cell temperature | 113.15 K |
| Ambient diffraction temperature | 113.15 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 | 0.1059 |
| Residual factor for significantly intense reflections | 0.0613 |
| Weighted residual factors for significantly intense reflections | 0.1473 |
| Weighted residual factors for all reflections included in the refinement | 0.181 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.059 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 273899 (current) | 2022-03-23 | cif/ Adding structures of 7129885, 7129886 via cif-deposit CGI script. |
7129885.cif |
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Users of the data should acknowledge the original authors of the
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