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Information card for entry 7245056
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| Coordinates | 7245056.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | cp2 |
|---|---|
| Formula | C13 H11 N O |
| Calculated formula | C13 H11 N O |
| Title of publication | Visible-light-promoted and chlorophyll-catalyzed aerobic desulfurization of thioamides to amides |
| Authors of publication | Yang, Zihui; Zhou, Haoyi; Wang, Lin; Zhang, Jingxuan; Xie, Hongqi; Liu, Yisong; Zeng, Jianguo; Cheng, Pi |
| Journal of publication | RSC Advances |
| Year of publication | 2022 |
| Journal volume | 12 |
| Journal issue | 27 |
| Pages of publication | 17190 - 17193 |
| a | 5.3315 ± 0.0006 Å |
| b | 7.7796 ± 0.0008 Å |
| c | 12.4238 ± 0.0014 Å |
| α | 72.694 ± 0.006° |
| β | 78.711 ± 0.005° |
| γ | 89.961 ± 0.005° |
| Cell volume | 481.54 ± 0.09 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1245 |
| Residual factor for significantly intense reflections | 0.1139 |
| Weighted residual factors for significantly intense reflections | 0.37 |
| Weighted residual factors for all reflections included in the refinement | 0.395 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.833 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 275953 (current) | 2022-06-10 | cif/ Adding structures of 7245056 via cif-deposit CGI script. |
7245056.cif |
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Users of the data should acknowledge the original authors of the
structural data.