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Information card for entry 1574094
Preview
| Coordinates | 1574094.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C176 H128 N16 Pd4 |
|---|---|
| Calculated formula | C176 H128 N16 Pd4 |
| Title of publication | Configurational Control of Low-Symmetry Heteroleptic Metal-Organic Cages with Asymmetric Ligands |
| Authors of publication | Yu, Hao; Guo, Ziteng; Tang, Jie; Han, Ningxu; Shi, Junjuan; Li, Meng; Zhang, Houyu; Wang, Ming |
| Journal of publication | Chemical Science |
| Year of publication | 2025 |
| a | 43.65 ± 0.002 Å |
| b | 43.65 ± 0.002 Å |
| c | 43.65 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 83167 ± 7 Å3 |
| Cell temperature | 273.15 K |
| Ambient diffraction temperature | 273.15 K |
| Number of distinct elements | 4 |
| Space group number | 229 |
| Hermann-Mauguin space group symbol | I m -3 m |
| Hall space group symbol | -I 4 2 3 |
| Residual factor for all reflections | 0.1934 |
| Residual factor for significantly intense reflections | 0.1841 |
| Weighted residual factors for significantly intense reflections | 0.516 |
| Weighted residual factors for all reflections included in the refinement | 0.575 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.582 |
| Diffraction radiation wavelength | 0.68874 Å |
| Diffraction radiation type | Synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 298338 (current) | 2025-03-08 | cif/ Adding structures of 1574092, 1574093, 1574094 via cif-deposit CGI script. |
1574094.cif |
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