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Information card for entry 1554248
Preview
| Coordinates | 1554248.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C29 H23 N O |
|---|---|
| Calculated formula | C29 H23 N O |
| SMILES | O(C)c1ccc(cc1)c1ccc(n2cc(cc2c2ccccc2)c2ccccc2)cc1 |
| Title of publication | A novel strategy for realizing dual state fluorescence and low-temperature phosphorescence |
| Authors of publication | Lei, Yunxiang; Dai, Wenbo; Liu, Zhiqi; Guo, Shuai; Cai, Zhengxu; Shi, Jianbing; Zheng, Xiaoyan; Zhi, Junge; Tong, Bin; Dong, Yuping |
| Journal of publication | Materials Chemistry Frontiers |
| Year of publication | 2019 |
| Journal volume | 3 |
| Journal issue | 2 |
| Pages of publication | 284 |
| a | 31.66 ± 0.006 Å |
| b | 5.901 ± 0.0012 Å |
| c | 22.932 ± 0.005 Å |
| α | 90° |
| β | 100.11 ± 0.03° |
| γ | 90° |
| Cell volume | 4217.8 ± 1.5 Å3 |
| Cell temperature | 153 ± 2 K |
| Ambient diffraction temperature | 153.15 K |
| Number of distinct elements | 4 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0955 |
| Residual factor for significantly intense reflections | 0.0781 |
| Weighted residual factors for significantly intense reflections | 0.2294 |
| Weighted residual factors for all reflections included in the refinement | 0.2679 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.267 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301780 (current) | 2025-08-19 | Add cross-references to PubChem compounds in COD range 1/55 Each referenced PubChem compound corresponds to the full crystal structure. |
1554248.cif |
| 237061 | 2019-11-24 | cif/ Adding structures of 1554245, 1554246, 1554247, 1554248, 1554249, 1554250 via cif-deposit CGI script. |
1554248.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.