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Information card for entry 1558863
Preview
| Coordinates | 1558863.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H54 Au3 Co2 N6 Na3.33 O45 S6 |
|---|---|
| Calculated formula | C30 H54 Au3 Co2 N6 Na3.33333 O43 S6 |
| Title of publication | Self-assembly of Cyclic Hexamers of γ-Cyclodextrin in a Metallosupramolecular Framework with D-Penicillamine |
| Authors of publication | Somsri, Supattra; Kuwamura, Naoto; Kojima, Tatsuhiro; Yoshinari, Nobuto; Konno, Takumi |
| Journal of publication | Chemical Science |
| Year of publication | 2020 |
| a | 41.171 ± 0.005 Å |
| b | 41.171 ± 0.005 Å |
| c | 41.171 ± 0.005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 69787 ± 15 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 199 |
| Hermann-Mauguin space group symbol | I 21 3 |
| Hall space group symbol | I 2b 2c 3 |
| Residual factor for all reflections | 0.1915 |
| Residual factor for significantly intense reflections | 0.097 |
| Weighted residual factors for significantly intense reflections | 0.2577 |
| Weighted residual factors for all reflections included in the refinement | 0.3054 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.885 |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 255413 (current) | 2020-08-18 | cif/ Adding structures of 1558863, 1558864, 1558865, 1558866 via cif-deposit CGI script. |
1558863.cif |
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Users of the data should acknowledge the original authors of the
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