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Information card for entry 7234273
Preview
| Coordinates | 7234273.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Common name | C6-ATTDK |
|---|---|
| Chemical name | 2,5,9,12-Tetrahexyl-7,14-dihydro-7,14-ethanoanthra [1,2-b:4,3-b?:5,6-b??:8,7-b???]tetrathiophene-15,16-dione |
| Formula | C51 H65 O2 S4 |
| Calculated formula | C51 H65 O2 S4 |
| Title of publication | Evaluation of semiconducting molecular thin films solution-processed via the photoprecursor approach: the case of hexyl-substituted thienoanthracenes |
| Authors of publication | Cassandre Quinton; Mitsuharu Suzuki; Yoshitaka Kaneshige; Yuki Tatenaka; Chiho Katagiri; Yuji Yamaguchi; Daiki Kuzuhara; Naoki Aratani; Ken-ichi Nakayama; Hiroko Yamada |
| Journal of publication | Journal of Materials Chemistry C |
| Year of publication | 2015 |
| Journal volume | 3 |
| Pages of publication | 5995 - 6005 |
| a | 10.9591 ± 0.0003 Å |
| b | 11.813 ± 0.0003 Å |
| c | 19.6453 ± 0.0005 Å |
| α | 104.659 ± 0.001° |
| β | 96.32 ± 0.001° |
| γ | 103.82 ± 0.001° |
| Cell volume | 2349.57 ± 0.11 Å3 |
| Cell temperature | 193 ± 2 K |
| Ambient diffraction temperature | 193 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0939 |
| Residual factor for significantly intense reflections | 0.0605 |
| Weighted residual factors for significantly intense reflections | 0.1633 |
| Weighted residual factors for all reflections included in the refinement | 0.193 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.102 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301866 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure. |
7234273.cif |
| 218962 | 2019-10-01 | cif/ Adding structures of 7234272, 7234273, 7234274 via cif-deposit CGI script. |
7234273.cif |
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Users of the data should acknowledge the original authors of the
structural data.