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Information card for entry 1554641
Preview
| Coordinates | 1554641.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C17 H19 N O2 S |
|---|---|
| Calculated formula | C17 H19 N O2 S |
| SMILES | c12ccccc1S(=O)(=O)c1ccccc1N2CCCCC |
| Title of publication | The odd‒even effect of alkyl chain in organic room temperature phosphorescence luminogens and the corresponding in vivo imaging |
| Authors of publication | Yang, Jie; Gao, Heqi; Wang, Yunsheng; Yu, Yun; Gong, Yanbin; Fang, Manman; Ding, Dan; Hu, Wenping; Tang, Ben Zhong; Li, Zhen |
| Journal of publication | Materials Chemistry Frontiers |
| Year of publication | 2019 |
| Journal volume | 3 |
| Journal issue | 7 |
| Pages of publication | 1391 |
| a | 11.377 ± 0.003 Å |
| b | 9.712 ± 0.003 Å |
| c | 13.362 ± 0.004 Å |
| α | 90° |
| β | 95.331 ± 0.004° |
| γ | 90° |
| Cell volume | 1470 ± 0.7 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0426 |
| Residual factor for significantly intense reflections | 0.0358 |
| Weighted residual factors for significantly intense reflections | 0.0966 |
| Weighted residual factors for all reflections included in the refinement | 0.1111 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.094 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 238019 (current) | 2019-11-24 | cif/ Adding structures of 1554641, 1554642, 1554643, 1554644, 1554645, 1554646 via cif-deposit CGI script. |
1554641.cif |
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Users of the data should acknowledge the original authors of the
structural data.