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Information card for entry 7223608
Preview
| Coordinates | 7223608.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C40 H43 Cl Co Mn N6 O6 |
|---|---|
| Calculated formula | C40 H43 Cl Co Mn N6 O6 |
| SMILES | c12ccccc1C=[N]1CC[N]3=Cc4ccccc4O[Mn]13([N]#C[Co]1345[N](=Cc6c(c(ccc6)OCC)O4)CC[NH]1CCC[N]3=Cc1cccc(c1O5)OCC)(O2)Cl |
| Title of publication | Field-induced slow relaxation of magnetization in dinuclear and trinuclear CoIII•••MnIII complexes |
| Authors of publication | Nemec, Ivan; Herchel, Radovan; Travnicek, Zdenek; Silha, Tomas |
| Journal of publication | RSC Adv. |
| Year of publication | 2015 |
| a | 8.5566 ± 0.0003 Å |
| b | 19.856 ± 0.0007 Å |
| c | 11.1842 ± 0.0003 Å |
| α | 90° |
| β | 100.397 ± 0.003° |
| γ | 90° |
| Cell volume | 1868.99 ± 0.11 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0317 |
| Residual factor for significantly intense reflections | 0.0272 |
| Weighted residual factors for significantly intense reflections | 0.0596 |
| Weighted residual factors for all reflections included in the refinement | 0.0606 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.978 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 171720 (current) | 2015-12-23 | cif/ Adding structures of 7223608, 7223609, 7223610, 7223611 via cif-deposit CGI script. |
7223608.cif |
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Users of the data should acknowledge the original authors of the
structural data.