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Information card for entry 7235275
Preview
| Coordinates | 7235275.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | 24b |
|---|---|
| Chemical name | 24b |
| Formula | C15 H8 N2 O5 S4 |
| Calculated formula | C15 H8 N2 O5 S4 |
| Title of publication | Straightforward access to aryl-substituted/fused 1,3-dithiole-2-chalcogenones by Cu-catalyzed C‒S coupling between aryl iodides and zinc‒thiolate complex (TBA)2[Zn(DMIT)2] |
| Authors of publication | Sun, Jibin; Lu, Xiaofeng; Shao, Jiafeng; Cui, Zili; Shao, Yu; Jiang, Guiyang; Yu, Wei; Shao, Xiangfeng |
| Journal of publication | RSC Advances |
| Year of publication | 2013 |
| Journal volume | 3 |
| Journal issue | 26 |
| Pages of publication | 10193 |
| a | 11.066 ± 0.012 Å |
| b | 11.928 ± 0.013 Å |
| c | 13.426 ± 0.014 Å |
| α | 78.033 ± 0.01° |
| β | 89.127 ± 0.01° |
| γ | 86.984 ± 0.009° |
| Cell volume | 1731 ± 3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1165 |
| Residual factor for significantly intense reflections | 0.0653 |
| Weighted residual factors for significantly intense reflections | 0.1516 |
| Weighted residual factors for all reflections included in the refinement | 0.177 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 232644 (current) | 2019-11-23 | cif/ Adding structures of 7235274, 7235275, 7235276, 7235277 via cif-deposit CGI script. |
7235275.cif |
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Users of the data should acknowledge the original authors of the
structural data.