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Information card for entry 4325514
Preview
| Coordinates | 4325514.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C23 H36 Dy N7 Ni O18 |
|---|---|
| Calculated formula | C23 H36 Dy N7 Ni O18 |
| SMILES | O=N(=O)[O-].O=N(=O)[O-].[O]1(C)c2cccc3c2[O]2[Dy]451([O]1c6c(C=[N]7CCC[N](=C3)[Ni]217([OH2])[N]#CC)cccc6[O]4C)(ON(=[O]5)=O)([OH2])([OH2])[OH2].O.N#CC |
| Title of publication | Preparation, Crystal Structures, and Magnetic Features for a Series of Dinuclear [NiIILnIII] Schiff-Base Complexes: Evidence for Slow Relaxation of the Magnetization for the DyIII Derivative |
| Authors of publication | Traian D. Pasatoiu; Jean-Pascal Sutter; Augustin M. Madalan; Fatima Zohra Chiboub Fellah; Carine Duhayon; Marius Andruh |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2011 |
| Journal volume | 50 |
| Pages of publication | 5890 - 5898 |
| a | 13.5166 ± 0.0002 Å |
| b | 10.4131 ± 0.0002 Å |
| c | 24.2996 ± 0.0005 Å |
| α | 90° |
| β | 98.6689 ± 0.0018° |
| γ | 90° |
| Cell volume | 3381.09 ± 0.11 Å3 |
| Cell temperature | 180 K |
| Ambient diffraction temperature | 180 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0301 |
| Residual factor for significantly intense reflections | 0.0256 |
| Weighted residual factors for all reflections | 0.0244 |
| Weighted residual factors for significantly intense reflections | 0.0234 |
| Weighted residual factors for all reflections included in the refinement | 0.0232 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.1112 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301838 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 4/32/ Each referenced PubChem compound corresponds to the full crystal structure. |
4325514.cif |
| 176432 | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
4325514.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4325514.cif |
| 44584 | 2012-03-16 | ../uploads/cif-deposit/cod/cif Adding structures of 4325514 via cif-deposit CGI script. |
4325514.cif |
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