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Information card for entry 1566026
Preview
| Coordinates | 1566026.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C45 H58 Cl8 Co3 N20 O14 |
|---|---|
| Calculated formula | C45 H58 Cl8 Co3 N20 O14 |
| Title of publication | Metal-induced different structures of four cyclopentanocucurbit[5]uril-based complexes |
| Authors of publication | Zheng, Jun; Meng, Ye; Zhang, Lin; Yang, Xinan; Ma, Peihua |
| Journal of publication | Inorganica Chimica Acta |
| Year of publication | 2022 |
| Journal volume | 529 |
| Pages of publication | 120669 |
| a | 27.808 ± 0.002 Å |
| b | 19.906 ± 0.0017 Å |
| c | 13.3851 ± 0.0011 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 7409.3 ± 1 Å3 |
| Cell temperature | 273.15 K |
| Ambient diffraction temperature | 273.15 K |
| Number of distinct elements | 6 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n m a |
| Hall space group symbol | -P 2ac 2n |
| Residual factor for all reflections | 0.0536 |
| Residual factor for significantly intense reflections | 0.0494 |
| Weighted residual factors for significantly intense reflections | 0.1401 |
| Weighted residual factors for all reflections included in the refinement | 0.1428 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.037 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 272104 (current) | 2022-01-18 | cif/ Adding structures of 1566025, 1566026, 1566027, 1566028 via cif-deposit CGI script. |
1566026.cif |
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Users of the data should acknowledge the original authors of the
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