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Information card for entry 4519209
Preview
| Coordinates | 4519209.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C33 H18 F18 Ir N9 |
|---|---|
| Calculated formula | C33 H18 F18 Ir N9 |
| Title of publication | Homoleptic Ir(III) Phosphors with 2-Phenyl-1,2,4-triazol-3-ylidene Chelates for Efficient Blue Organic Light-Emitting Diodes. |
| Authors of publication | You, Caifa; Wang, Xue-Qi; Zhou, Xiuwen; Yuan, Yi; Liao, Liang-Sheng; Liao, Yu-Chan; Chou, Pi-Tai; Chi, Yun |
| Journal of publication | ACS applied materials & interfaces |
| Year of publication | 2021 |
| Journal volume | 13 |
| Journal issue | 49 |
| Pages of publication | 59023 - 59034 |
| a | 10.799 ± 0.003 Å |
| b | 20.957 ± 0.007 Å |
| c | 17.573 ± 0.003 Å |
| α | 90° |
| β | 105.397 ± 0.009° |
| γ | 90° |
| Cell volume | 3834.3 ± 1.8 Å3 |
| Cell temperature | 238 ± 2 K |
| Ambient diffraction temperature | 238 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0472 |
| Residual factor for significantly intense reflections | 0.0313 |
| Weighted residual factors for significantly intense reflections | 0.0668 |
| Weighted residual factors for all reflections included in the refinement | 0.0734 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 271705 (current) | 2022-01-03 | cif/ Adding structures of 4519209 via cif-deposit CGI script. |
4519209.cif |
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Users of the data should acknowledge the original authors of the
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