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Information card for entry 1573008
Preview
| Coordinates | 1573008.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C109 H70 Cl2 N4 |
|---|---|
| Calculated formula | C109 H70 Cl2 N4 |
| Title of publication | Enhanced chiroptical activity for narrow deep-blue emission in axial chiral frameworks <i>via</i> three-dimensional interlocking. |
| Authors of publication | Mo, Xuechao; Chen, Guohao; Li, Yulan; Xiao, Biao; Chen, Xuefeng; Yin, Xiaojun; Yang, Chuluo |
| Journal of publication | Chemical science |
| Year of publication | 2024 |
| Journal volume | 15 |
| Journal issue | 42 |
| Pages of publication | 17663 - 17670 |
| a | 25.6752 ± 0.0014 Å |
| b | 7.7929 ± 0.0004 Å |
| c | 22.2195 ± 0.0018 Å |
| α | 90° |
| β | 123.416 ± 0.002° |
| γ | 90° |
| Cell volume | 3710.9 ± 0.4 Å3 |
| Cell temperature | 170 K |
| Ambient diffraction temperature | 170 K |
| Number of distinct elements | 4 |
| Space group number | 5 |
| Hermann-Mauguin space group symbol | C 1 2 1 |
| Hall space group symbol | C 2y |
| Residual factor for all reflections | 0.0626 |
| Residual factor for significantly intense reflections | 0.0449 |
| Weighted residual factors for significantly intense reflections | 0.0995 |
| Weighted residual factors for all reflections included in the refinement | 0.1066 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
| Diffraction radiation wavelength | 1.34139 Å |
| Diffraction radiation type | GaKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 295752 (current) | 2024-11-04 | cif/ Adding structures of 1573006, 1573007, 1573008, 1573009 via cif-deposit CGI script. |
1573008.cif |
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Users of the data should acknowledge the original authors of the
structural data.