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Information card for entry 7108829
Preview
| Coordinates | 7108829.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C58 H71 B Cu F4 N2 O6.5 P2 |
|---|---|
| Calculated formula | C56 H66 B Cu F4 N2 O6 P2 |
| Title of publication | Dynamic topomerization of Cu(I)=complexed pseudorotaxanes |
| Authors of publication | Meera Mohankumar; Michel Holler; Michel Schmitt; Jean-Pierre Sauvage; Jean-Francois Nierengarten |
| Journal of publication | Chem.Commun. |
| Year of publication | 2012 |
| Journal volume | 49 |
| Pages of publication | 1261 |
| a | 11.795 ± 0.0007 Å |
| b | 13.2034 ± 0.0007 Å |
| c | 19.7058 ± 0.0011 Å |
| α | 106.642 ± 0.001° |
| β | 106.201 ± 0.001° |
| γ | 91.402 ± 0.001° |
| Cell volume | 2805.3 ± 0.3 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1298 |
| Residual factor for significantly intense reflections | 0.0905 |
| Weighted residual factors for significantly intense reflections | 0.2677 |
| Weighted residual factors for all reflections included in the refinement | 0.2942 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.104 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
Version history
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