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Information card for entry 7234082
Preview
| Coordinates | 7234082.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Common name | BNQ-Me |
|---|---|
| Formula | C22 H16 O4 |
| Calculated formula | C22 H16 O4 |
| SMILES | O(C1=CC(=C2\C=C(OC)c3ccccc3C2=O)\C(=O)c2c1cccc2)C |
| Title of publication | Ambipolar transistor properties of 2,2'-binaphthosemiquinones |
| Authors of publication | Toshiki Higashino; Shohei Kumeta; Sumika Tamura; Yoshio Ando; Ken Ohmori; Keisuke Suzuki; Takehiko Mori |
| Journal of publication | Journal of Materials Chemistry C |
| Year of publication | 2015 |
| Journal volume | 3 |
| Pages of publication | 1588 - 1594 |
| a | 4.557 ± 0.0005 Å |
| b | 18.5706 ± 0.0018 Å |
| c | 18.986 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1606.7 ± 0.3 Å3 |
| Cell temperature | 293 K |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 3 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for significantly intense reflections | 0.0859 |
| Weighted residual factors for all reflections included in the refinement | 0.1917 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.089 |
| Diffraction radiation wavelength | 1.54187 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| 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. |
7234082.cif |
| 218738 | 2019-09-23 | cif/ Adding structures of 7234082 via cif-deposit CGI script. |
7234082.cif |
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Users of the data should acknowledge the original authors of the
structural data.