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Information card for entry 1577089
Preview
| Coordinates | 1577089.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C73.5 H59 Cl N O |
|---|---|
| Calculated formula | C73.5 H59 Cl N O |
| Title of publication | A Dual-Responsive Cationic Acridinium Nanohoop: Redox Activity and Acid/Base-Controlled Reversible Guest Capture and Release |
| Authors of publication | Ming, Jiao; Zhang, Jin; Hu, Yan; Lan, Kai; Zhang, Dongmei; Li, Ping; Miao, Jiarong; Jiang, Jiyong; Zhang, Xiaobo; Zhong, Hanchi; Yu, Peiyuan; Cheng, Chuyang |
| Journal of publication | Chemical Science |
| Year of publication | 2026 |
| a | 10.5922 ± 0.0009 Å |
| b | 17.7237 ± 0.0015 Å |
| c | 19.0853 ± 0.0017 Å |
| α | 113.419 ± 0.006° |
| β | 92.807 ± 0.007° |
| γ | 104.671 ± 0.006° |
| Cell volume | 3135.1 ± 0.5 Å3 |
| Cell temperature | 213 K |
| Ambient diffraction temperature | 213 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.2127 |
| Residual factor for significantly intense reflections | 0.1185 |
| Weighted residual factors for significantly intense reflections | 0.2652 |
| Weighted residual factors for all reflections included in the refinement | 0.3195 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.828 |
| Diffraction radiation wavelength | 1.34139 Å |
| Diffraction radiation type | GaKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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Users of the data should acknowledge the original authors of the
structural data.