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Information card for entry 7246387
Preview
| Coordinates | 7246387.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C14 H6 S2 |
|---|---|
| Calculated formula | C14 H6 S2 |
| Title of publication | Linear π-conjugated polycyclic compounds consisting of four-, five-, and six-membered rings: benzo[1'',2'':3,4;4'',5'':3',4']bis(cyclobuta[1,2-<i>c</i>]thiophene). |
| Authors of publication | Kuroiwa, Tatsuru; Asai, Daisuke; Hashimoto, Shingo; Tahara, Kazukuni |
| Journal of publication | RSC advances |
| Year of publication | 2023 |
| Journal volume | 13 |
| Journal issue | 7 |
| Pages of publication | 4578 - 4583 |
| a | 12.2173 ± 0.0014 Å |
| b | 7.2881 ± 0.0008 Å |
| c | 5.772 ± 0.0006 Å |
| α | 90° |
| β | 90.868 ± 0.01° |
| γ | 90° |
| Cell volume | 513.89 ± 0.1 Å3 |
| Cell temperature | 173 K |
| Ambient diffraction temperature | 173 K |
| Number of distinct elements | 3 |
| 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 | 0.1008 |
| Residual factor for significantly intense reflections | 0.0552 |
| Weighted residual factors for significantly intense reflections | 0.0983 |
| Weighted residual factors for all reflections included in the refinement | 0.1123 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.081 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 281303 (current) | 2023-03-04 | cif/ Adding structures of 7246387, 7246388 via cif-deposit CGI script. |
7246387.cif |
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