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Information card for entry 4519045
Preview
| Coordinates | 4519045.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C39 H34 B N O |
|---|---|
| Calculated formula | C39 H34 B N O |
| Title of publication | Blue TADF Emitters Based on <i>B</i>-Heterotriangulene Acceptors for Highly Efficient OLEDs with Reduced Efficiency Roll-Off. |
| Authors of publication | Lee, Young Hoon; Lee, Woochan; Lee, Taehwan; Lee, Donggyun; Jung, Jaehoon; Yoo, Seunghyup; Lee, Min Hyung |
| Journal of publication | ACS applied materials & interfaces |
| Year of publication | 2021 |
| Journal volume | 13 |
| Journal issue | 38 |
| Pages of publication | 45778 - 45788 |
| a | 14.5452 ± 0.0002 Å |
| b | 14.5452 ± 0.0002 Å |
| c | 29.1039 ± 0.0008 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 6157.3 ± 0.2 Å3 |
| Cell temperature | 193 ± 2 K |
| Ambient diffraction temperature | 193 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 114 |
| Hermann-Mauguin space group symbol | P -4 21 c |
| Hall space group symbol | P -4 2n |
| Residual factor for all reflections | 0.0431 |
| Residual factor for significantly intense reflections | 0.0391 |
| Weighted residual factors for significantly intense reflections | 0.0991 |
| Weighted residual factors for all reflections included in the refinement | 0.1023 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 269472 (current) | 2021-10-03 | cif/ Adding structures of 4519045 via cif-deposit CGI script. |
4519045.cif |
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Users of the data should acknowledge the original authors of the
structural data.