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Information card for entry 7246388
Preview
| Coordinates | 7246388.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H14 S2 |
|---|---|
| Calculated formula | C18 H14 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 | 5.9039 ± 0.0002 Å |
| b | 16.2762 ± 0.0006 Å |
| c | 7.6534 ± 0.0003 Å |
| α | 90° |
| β | 98.902 ± 0.004° |
| γ | 90° |
| Cell volume | 726.58 ± 0.05 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 | 0.0343 |
| Residual factor for significantly intense reflections | 0.0311 |
| Weighted residual factors for significantly intense reflections | 0.093 |
| Weighted residual factors for all reflections included in the refinement | 0.0972 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.089 |
| 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. |
7246388.cif |
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