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Information card for entry 7251054
Preview
| Coordinates | 7251054.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | 1 |
|---|---|
| Formula | C30 H22 Br2 O4 S |
| Calculated formula | C30 H22 Br2 O4 S |
| Title of publication | Design, synthesis and acaricidal activity of tetrahydrothiophene derivatives against Psoroptes cuniculi |
| Authors of publication | Chen, Dongdong; Wang, Yan; Wu, Yujun; Yu, Qiaoqiao; Wang, Yunhan; Zheng, Junyao; Ying, Zhong; Hou, Changhui |
| Journal of publication | RSC Advances |
| Year of publication | 2025 |
| Journal volume | 15 |
| Journal issue | 46 |
| Pages of publication | 39028 - 39036 |
| a | 11.8305 ± 0.0003 Å |
| b | 17.7949 ± 0.0004 Å |
| c | 12.865 ± 0.0004 Å |
| α | 90° |
| β | 103.504 ± 0.003° |
| γ | 90° |
| Cell volume | 2633.5 ± 0.13 Å3 |
| Cell temperature | 293 K |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0846 |
| Residual factor for significantly intense reflections | 0.047 |
| Weighted residual factors for significantly intense reflections | 0.0894 |
| Weighted residual factors for all reflections included in the refinement | 0.1037 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.011 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 302948 (current) | 2025-10-17 | cif/ Adding structures of 7251054 via cif-deposit CGI script. |
7251054.cif |
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Users of the data should acknowledge the original authors of the
structural data.