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Information card for entry 1560599
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| Coordinates | 1560599.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H18 N4 S |
|---|---|
| Calculated formula | C30 H18 N4 S |
| Title of publication | Hybridized Local and Charge-Transfer Excited State Fluorophores Enabling Organic Light-Emitting Diodes with Record High Efficiencies Close to 20% |
| Authors of publication | Liu, Tiantian; Chen, Xiaojie; Zhao, Juan; Wei, Weichun; Mao, Zhu; Wu, William; Jiao, Shibo; Liu, Yang; Yang, Zhiyong; Chi, Zhenguo |
| Journal of publication | Chemical Science |
| Year of publication | 2021 |
| a | 25.7763 ± 0.0005 Å |
| b | 25.7763 ± 0.0005 Å |
| c | 17.9852 ± 0.0004 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 10348.7 ± 0.4 Å3 |
| Cell temperature | 149.99 ± 0.14 K |
| Ambient diffraction temperature | 149.99 ± 0.14 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | R -3 :H |
| Hall symmetry space group | -R 3 |
| Residual factor for all reflections | 0.0462 |
| Residual factor for significantly intense reflections | 0.041 |
| Weighted residual factors for significantly intense reflections | 0.1044 |
| Weighted residual factors for all reflections included in the refinement | 0.1108 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 262173 (current) | 2021-02-24 | cif/ Adding structures of 1560599, 1560600, 1560601 via cif-deposit CGI script. |
1560599.cif |
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