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Information card for entry 1575276
Preview
| Coordinates | 1575276.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | tCzPAzBN |
|---|---|
| Formula | C72 H68 B N3 |
| Calculated formula | C72 H68 B N3 |
| Title of publication | Strategic Azepine Engineering Realizes Highly Efficient and Stable Blue Narrowband Light-Emitting Diodes |
| Authors of publication | Chen, Yi-Kuan; Lei, Jian; Chao, Yu-Chieh; Kung, Yu-Cheng; Hung, Wen-Yi; Hsu, Liang-Yan; Wu, Tien-Lin |
| Journal of publication | Materials Horizons |
| Year of publication | 2025 |
| a | 11.46318 ± 0.00007 Å |
| b | 29.88427 ± 0.00019 Å |
| c | 32.1321 ± 0.00017 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 11007.5 ± 0.11 Å3 |
| Cell temperature | 99.99 ± 0.1 K |
| Ambient diffraction temperature | 99.99 ± 0.1 K |
| Number of distinct elements | 4 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.0445 |
| Residual factor for significantly intense reflections | 0.0374 |
| Weighted residual factors for significantly intense reflections | 0.0929 |
| Weighted residual factors for all reflections included in the refinement | 0.0971 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301427 (current) | 2025-08-01 | cif/ Adding structures of 1575274, 1575275, 1575276 via cif-deposit CGI script. |
1575276.cif |
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