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Information card for entry 7159907
Preview
| Coordinates | 7159907.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H13 F3 N2 O S |
|---|---|
| Calculated formula | C18 H13 F3 N2 O S |
| Title of publication | Efficient Synthesis of SCF3-Containing 3-Alkenylquinoxalinones via Three-Component Radical Cascade Reaction |
| Authors of publication | Wang, Si-Yu; Liu, Chu; Yang, Wei; Tian, Zhong-Ying; Yuan, Lin; Xie, Long-Yong |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2024 |
| a | 4.788 ± 0.0012 Å |
| b | 10.509 ± 0.003 Å |
| c | 16.019 ± 0.004 Å |
| α | 90.169 ± 0.003° |
| β | 91.422 ± 0.003° |
| γ | 90.026 ± 0.003° |
| Cell volume | 805.8 ± 0.4 Å3 |
| Cell temperature | 296.15 K |
| Ambient diffraction temperature | 296.15 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0582 |
| Residual factor for significantly intense reflections | 0.0449 |
| Weighted residual factors for significantly intense reflections | 0.1232 |
| Weighted residual factors for all reflections included in the refinement | 0.134 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 291284 (current) | 2024-04-19 | cif/ Adding structures of 7159907 via cif-deposit CGI script. |
7159907.cif |
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Users of the data should acknowledge the original authors of the
structural data.