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Information card for entry 7248381
Preview
| Coordinates | 7248381.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C27 H21 F2 N O6 S |
|---|---|
| Calculated formula | C27 H21 F2 N O6 S |
| Title of publication | Photocatalyst-free H2O-regulated and regiodivergent multicomponent hydrogenation/bifunctional sulfonylation of alkynes |
| Authors of publication | Sun, Jie; Wang, Chaodong; Wu, Chunlei; Wang, Wenjian; Zeng, Yue; Song, Shengjie; Chen, Zhiwei; Li, Jianjun |
| Journal of publication | Green Chemistry |
| Year of publication | 2024 |
| Journal volume | 26 |
| Journal issue | 6 |
| Pages of publication | 3301 - 3307 |
| a | 10.2939 ± 0.0004 Å |
| b | 9.7381 ± 0.0004 Å |
| c | 25.5602 ± 0.0011 Å |
| α | 90° |
| β | 91.73 ± 0.002° |
| γ | 90° |
| Cell volume | 2561.06 ± 0.18 Å3 |
| Cell temperature | 170 K |
| Ambient diffraction temperature | 170 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0662 |
| Residual factor for significantly intense reflections | 0.0446 |
| Weighted residual factors for significantly intense reflections | 0.1016 |
| Weighted residual factors for all reflections included in the refinement | 0.1122 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.0574 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 290785 (current) | 2024-04-04 | cif/ Adding structures of 7248381, 7248382 via cif-deposit CGI script. |
7248381.cif |
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