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Information card for entry 7207717
Preview
| Coordinates | 7207717.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Common name | _C6-DBTDT |
|---|---|
| Chemical name | _C6-DBTDT |
| Formula | C28 H32 S3 |
| Calculated formula | C28 H32 S3 |
| SMILES | s1c2cc(ccc2c2c1c1c(c3c(cc(cc3)CCCCCC)s1)s2)CCCCCC |
| Title of publication | High-performance organic field-effect transistors based on dihexyl-substituted dibenzo[d,d′]thieno[3,2-b;4,5-b′]dithiophene |
| Authors of publication | Miyata, Yasuo; Yoshikawa, Eiji; Minari, Takeo; Tsukagoshi, Kazuhito; Yamaguchi, Shigehiro |
| Journal of publication | Journal of Materials Chemistry |
| Year of publication | 2012 |
| Journal volume | 22 |
| Journal issue | 16 |
| Pages of publication | 7715 |
| a | 4.12 ± 0.03 Å |
| b | 11.09 ± 0.11 Å |
| c | 52.8 ± 0.6 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2412 ± 4 Å3 |
| Cell temperature | 123 ± 2 K |
| Ambient diffraction temperature | 123 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 57 |
| Hermann-Mauguin space group symbol | P b c m |
| Hall space group symbol | -P 2c 2b |
| Residual factor for all reflections | 0.1328 |
| Residual factor for significantly intense reflections | 0.1186 |
| Weighted residual factors for significantly intense reflections | 0.3177 |
| Weighted residual factors for all reflections included in the refinement | 0.3325 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.519 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301863 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/20/ Each referenced PubChem compound corresponds to the full crystal structure. |
7207717.cif |
| 180408 | 2016-03-26 | cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/77. |
7207717.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7207717.cif |
| 52198 | 2012-04-07 | ../uploads/cif-deposit/cod/cif Adding structures of 7207717 via cif-deposit CGI script. |
7207717.cif |
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Users of the data should acknowledge the original authors of the
structural data.