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Information card for entry 7244797
Preview
| Coordinates | 7244797.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C49.5 H46 N14 O9.5 Zn |
|---|---|
| Calculated formula | C46 H32 N14 O6 Zn |
| Title of publication | Supramolecular assemblies of Zn(II) complexes with D-π-A ligand for sensing specific organic molecules |
| Authors of publication | huang, ziqing; Chen, Jia-Qi; Zhao, Shu-Man; Qiu, Zhao-Feng; Zhao, Yue; Sun, Wei-Yin |
| Journal of publication | CrystEngComm |
| Year of publication | 2022 |
| a | 8.7701 ± 0.0005 Å |
| b | 14.3922 ± 0.0008 Å |
| c | 18.8489 ± 0.001 Å |
| α | 78.414 ± 0.003° |
| β | 79.587 ± 0.003° |
| γ | 72.876 ± 0.003° |
| Cell volume | 2208.5 ± 0.2 Å3 |
| Cell temperature | 193 ± 2 K |
| Ambient diffraction temperature | 193 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 | 0.0781 |
| Residual factor for significantly intense reflections | 0.057 |
| Weighted residual factors for significantly intense reflections | 0.1656 |
| Weighted residual factors for all reflections included in the refinement | 0.1792 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.069 |
| Diffraction radiation wavelength | 1.34139 Å |
| Diffraction radiation type | GaKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 274564 (current) | 2022-04-19 | cif/ Adding structures of 7244797, 7244798, 7244799 via cif-deposit CGI script. |
7244797.cif |
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Users of the data should acknowledge the original authors of the
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