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Information card for entry 4133988
Preview
| Coordinates | 4133988.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C228 H206 B7 F28 N26 Pd12 S12 |
|---|---|
| Calculated formula | C228 H206 B7 F28 N26 Pd12 S12 |
| Title of publication | Self-Assembly, Structural Transformation and Guest-Binding Properties of Supramolecular Assemblies with Triangular Metal-Metal Bonded Units. |
| Authors of publication | Wang, Li-Juan; Li, Xin; Bai, Sha; Wang, Yaoyu; Han, Ying-Feng |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2020 |
| a | 43.2323 ± 0.0018 Å |
| b | 43.2323 ± 0.0018 Å |
| c | 76.187 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 123318 ± 9 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 149.96 K |
| Number of distinct elements | 7 |
| Space group number | 167 |
| Hermann-Mauguin space group symbol | R -3 c :H |
| Hall space group symbol | -R 3 2"c |
| Residual factor for all reflections | 0.0836 |
| Residual factor for significantly intense reflections | 0.0629 |
| Weighted residual factors for significantly intense reflections | 0.1733 |
| Weighted residual factors for all reflections included in the refinement | 0.1941 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.024 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 247124 (current) | 2020-01-24 | cif/ Adding structures of 4133988 via cif-deposit CGI script. |
4133988.cif |
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