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Information card for entry 1554250
Preview
| Coordinates | 1554250.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C29 H20 N2 |
|---|---|
| Calculated formula | C29 H20 N2 |
| SMILES | N#Cc1ccc(cc1)c1ccc(n2cc(c(c2)c2ccccc2)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 | 8.4662 ± 0.0017 Å |
| b | 15.145 ± 0.003 Å |
| c | 17.692 ± 0.004 Å |
| α | 106.62 ± 0.03° |
| β | 95.32 ± 0.03° |
| γ | 91.57 ± 0.03° |
| Cell volume | 2160.9 ± 0.9 Å3 |
| Cell temperature | 153 ± 2 K |
| Ambient diffraction temperature | 153.15 K |
| Number of distinct elements | 3 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.21 |
| Residual factor for significantly intense reflections | 0.1627 |
| Weighted residual factors for significantly intense reflections | 0.3918 |
| Weighted residual factors for all reflections included in the refinement | 0.4353 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.239 |
| 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. |
1554250.cif |
| 237061 | 2019-11-24 | cif/ Adding structures of 1554245, 1554246, 1554247, 1554248, 1554249, 1554250 via cif-deposit CGI script. |
1554250.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
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Users of the data should acknowledge the original authors of the
structural data.