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Information card for entry 1552225
Preview
| Coordinates | 1552225.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H22 F5 N3 |
|---|---|
| Calculated formula | C25 H22 F5 N3 |
| SMILES | Fc1c(C2=NN(c3ccc(cc3)N(CC)CC)C(c3ccccc3)C2)c(F)c(F)c(F)c1F |
| Title of publication | Multifunctional pyrazoline based AIEgens: real-time tracking and specific protein “fishing” of lipid droplets |
| Authors of publication | Zhao, Na; Li, Yan; Yang, Weiyao; Zhuang, Jiabao; Li, Yue; Li, Nan |
| Journal of publication | Chemical Science |
| Year of publication | 2019 |
| a | 19.5027 ± 0.0009 Å |
| b | 5.9539 ± 0.0003 Å |
| c | 20.2366 ± 0.0009 Å |
| α | 90° |
| β | 111.013 ± 0.005° |
| γ | 90° |
| Cell volume | 2193.55 ± 0.19 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.0925 |
| Residual factor for significantly intense reflections | 0.07 |
| Weighted residual factors for significantly intense reflections | 0.2284 |
| Weighted residual factors for all reflections included in the refinement | 0.2659 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 217532 (current) | 2019-08-15 | cif/ Adding structures of 1552224, 1552225, 1552226 via cif-deposit CGI script. |
1552225.cif |
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Users of the data should acknowledge the original authors of the
structural data.