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Information card for entry 1569286
Preview
| Coordinates | 1569286.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C24 H32 O8 S |
|---|---|
| Calculated formula | C24 H32 O8 S |
| Title of publication | Hydroxide-Mediated SNAr Rearrangement for Synthesis of Novel Depside Derivatives Containing Diaryl Ether Skeleton as Antitumor Agents |
| Authors of publication | Yu, Xiang; Xi, Yinkai; Sui, Yi; Liu, Yang; Chen, Guifen; Zhang, Minjie; Zhang, Yan; Luo, Guoyong; Long, Yi; Yang, Wude |
| Journal of publication | Molecules |
| Year of publication | 2023 |
| Journal volume | 28 |
| Journal issue | 11 |
| Pages of publication | 4303 |
| a | 12.3291 ± 0.0011 Å |
| b | 7.9656 ± 0.0008 Å |
| c | 25.755 ± 0.002 Å |
| α | 90° |
| β | 100.544 ± 0.003° |
| γ | 90° |
| Cell volume | 2486.7 ± 0.4 Å3 |
| Cell temperature | 273 ± 2 K |
| Ambient diffraction temperature | 273 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.0986 |
| Residual factor for significantly intense reflections | 0.0601 |
| Weighted residual factors for significantly intense reflections | 0.1503 |
| Weighted residual factors for all reflections included in the refinement | 0.1726 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 284362 (current) | 2023-06-06 | cif/ Adding structures of 1569286 via cif-deposit CGI script. |
1569286.cif |
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Users of the data should acknowledge the original authors of the
structural data.