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Information card for entry 7239608
Preview
| Coordinates | 7239608.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C27 H26 O4 S Si2 |
|---|---|
| Calculated formula | C27 H26 O4 S Si2 |
| Title of publication | Sequential cycloaddition and ring expansion reaction of arynes and methylenebenzothiopheneones: synthesis of a benzo-fused eight-membered ring via sulfonium ylides |
| Authors of publication | Xiao, Peng; Su, Shikuan; Wang, Wei; Cao, Weiguo; Chen, Jie; Li, Jian; Chen, Yali |
| Journal of publication | RSC Advances |
| Year of publication | 2019 |
| Journal volume | 9 |
| Journal issue | 67 |
| Pages of publication | 39119 |
| a | 10.329 ± 0.005 Å |
| b | 17.205 ± 0.007 Å |
| c | 15.111 ± 0.007 Å |
| α | 90° |
| β | 99.615 ± 0.005° |
| γ | 90° |
| Cell volume | 2648 ± 2 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 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 | 0.0468 |
| Residual factor for significantly intense reflections | 0.0406 |
| Weighted residual factors for significantly intense reflections | 0.1072 |
| Weighted residual factors for all reflections included in the refinement | 0.1133 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 244826 (current) | 2019-11-30 | cif/ Adding structures of 7239607, 7239608 via cif-deposit CGI script. |
7239608.cif |
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Users of the data should acknowledge the original authors of the
structural data.