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Information card for entry 1551393
Preview
| Coordinates | 1551393.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C764 H707 B264 Co12 N115 O |
|---|---|
| Calculated formula | C744 H693.244 B276 Co12 N117 O |
| Title of publication | Stereochemical plasticity modulates cooperative binding in a CoII12L6 cuboctahedron |
| Authors of publication | Felix J. Rizzuto; Jonathan R. Nitschke |
| Journal of publication | Nature Chemistry |
| Year of publication | 2017 |
| Journal volume | 10 |
| Pages of publication | 903 - 908 |
| a | 26.438 ± 0.013 Å |
| b | 30.374 ± 0.016 Å |
| c | 31.047 ± 0.01 Å |
| α | 67.3 ± 0.04° |
| β | 84.86 ± 0.04° |
| γ | 78.93 ± 0.07° |
| Cell volume | 22569 ± 2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1467 |
| Residual factor for significantly intense reflections | 0.1303 |
| Weighted residual factors for significantly intense reflections | 0.3477 |
| Weighted residual factors for all reflections included in the refinement | 0.3628 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.988 |
| Diffraction radiation wavelength | 0.6889 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 215922 (current) | 2019-06-13 | cif/ Adding structures of 1551393 via cif-deposit CGI script. |
1551393.cif |
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