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Information card for entry 4325515
Preview
| Coordinates | 4325515.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C38 H58 N8 Ni2 O30 Yb2 |
|---|---|
| Calculated formula | C38 H58 N8 Ni2 O30 Yb2 |
| SMILES | C[O]1c2c3c(C=[N]4[Ni]56([O]3[Yb]3781(ON(=[O]3)=O)([O]5c1c([O]7C)cccc1C=[N]6CCC4)[OH][Yb]1345(ON(=[O]5)=O)([O](C)c5c6c(C=[N]7CCC[N]9=Cc%10cccc(c%10[O]3[Ni]79([O]16)([OH2])[OH2])[O]4C)ccc5)[OH]8)([OH2])[OH2])ccc2.N(=O)(=O)[O-].O.O.N(=O)(=O)[O-].O.O |
| 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 | 11.1489 ± 0.0004 Å |
| b | 17.1833 ± 0.0007 Å |
| c | 15.3045 ± 0.0007 Å |
| α | 90° |
| β | 108.659 ± 0.002° |
| γ | 90° |
| Cell volume | 2777.9 ± 0.2 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 | 0.0578 |
| Residual factor for significantly intense reflections | 0.0334 |
| Weighted residual factors for all reflections | 0.0578 |
| Weighted residual factors for significantly intense reflections | 0.0333 |
| Weighted residual factors for all reflections included in the refinement | 0.0318 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.0856 |
| 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. |
4325515.cif |
| 176432 | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
4325515.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4325515.cif |
| 44585 | 2012-03-16 | ../uploads/cif-deposit/cod/cif Adding structures of 4325515 via cif-deposit CGI script. |
4325515.cif |
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Users of the data should acknowledge the original authors of the
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