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Information card for entry 1547306
Preview
| Coordinates | 1547306.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C10 H8 O2 |
|---|---|
| Calculated formula | C10 H8 O2 |
| SMILES | o1cccc1/C=C/c1occc1 |
| Title of publication | Evaluation of (E)-1,2-di(furan-2-yl)ethene as building unit in diketopyrrolopyrrole alternating copolymers for transistors |
| Authors of publication | Stefan, Mihaela Corina; Du, Jia; Bulumulla, Chandima; Mejia, Israel; McCandless, Gregory T.; Biewer, Michael C. |
| Journal of publication | Polym. Chem. |
| Year of publication | 2017 |
| a | 9.49 ± 0.003 Å |
| b | 11.322 ± 0.004 Å |
| c | 7.377 ± 0.004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 792.6 ± 0.6 Å3 |
| Cell temperature | 90 ± 2 K |
| Ambient diffraction temperature | 90 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 60 |
| Hermann-Mauguin space group symbol | P b c n |
| Hall space group symbol | -P 2n 2ab |
| Residual factor for all reflections | 0.099 |
| Residual factor for significantly intense reflections | 0.0615 |
| Weighted residual factors for significantly intense reflections | 0.1135 |
| Weighted residual factors for all reflections included in the refinement | 0.1262 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.074 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 201167 (current) | 2017-09-22 | cif/ Adding structures of 1547306 via cif-deposit CGI script. |
1547306.cif |
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Users of the data should acknowledge the original authors of the
structural data.