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Information card for entry 7132161
Preview
| Coordinates | 7132161.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | 1-cis |
|---|---|
| Formula | C28 H32 N6 O2 |
| Calculated formula | C28 H32 N6 O2 |
| Title of publication | Photo–Controllable Binding and Release of HP2O73– Using an Azobenzene based Smart Macrocycle |
| Authors of publication | Xiong, Shenglun; Zhang, Yi; Jiang, Yunqi; Wang, Fei; Zhou, Wei; Li, Aimin; Zhang, Qinpeng; Wang, Qiuan; He, Qing |
| Journal of publication | Chemical Communications |
| Year of publication | 2023 |
| a | 11.4339 ± 0.0005 Å |
| b | 9.3891 ± 0.0004 Å |
| c | 24.5636 ± 0.0011 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2637 ± 0.2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 4 |
| Space group number | 41 |
| Hermann-Mauguin space group symbol | A e a 2 |
| Hall space group symbol | A 2 -2ab |
| Residual factor for all reflections | 0.0373 |
| Residual factor for significantly intense reflections | 0.0356 |
| Weighted residual factors for significantly intense reflections | 0.0917 |
| Weighted residual factors for all reflections included in the refinement | 0.0941 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.0647 |
| 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 |
|---|---|---|---|
| 286604 (current) | 2023-10-01 | cif/ Adding structures of 7132161, 7132162 via cif-deposit CGI script. |
7132161.cif |
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