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Information card for entry 7055617
Preview
| Coordinates | 7055617.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C27 H34 La N5 Ni O16 |
|---|---|
| Calculated formula | C27 H34 La N5 Ni O16 |
| SMILES | c12c3cccc1C=[N]1[Ni]456([O]2[La]278(ON(=[O]2)=O)([O]6c2c(C=[N]4OCCO1)cccc2[O]8C)([O]3C)([OH]C)(ON(=[O]7)=O)[O]=C(C)O5)[n]1ccccc1.CO |
| Title of publication | Nine self-assembled nickel(ii)–lanthanide(iii) heterometallic complexes constructed from a Salamo-type bisoxime and bearing a N- or O-donor auxiliary ligand: syntheses, structures and magnetic properties |
| Authors of publication | Dong, Wen-Kui; Ma, Jian-Chun; Zhu, Li-Chun; Zhang, Yang |
| Journal of publication | New J. Chem. |
| Year of publication | 2016 |
| Journal volume | 40 |
| Journal issue | 8 |
| Pages of publication | 6998 |
| a | 9.3155 ± 0.0014 Å |
| b | 17.453 ± 0.003 Å |
| c | 21.676 ± 0.003 Å |
| α | 90° |
| β | 94.652 ± 0.002° |
| γ | 90° |
| Cell volume | 3512.5 ± 0.9 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0476 |
| Residual factor for significantly intense reflections | 0.0344 |
| Weighted residual factors for significantly intense reflections | 0.0921 |
| Weighted residual factors for all reflections included in the refinement | 0.1204 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.091 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301851 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/05/ Each referenced PubChem compound corresponds to the full crystal structure. |
7055617.cif |
| 278046 | 2022-09-21 | cod/ Updated space group information using the 'cif_filter' program. |
7055617.cif |
| 185618 | 2016-08-07 | cif/ Updating files of 7055617, 7055618, 7055619, 7055620, 7055621, 7055622, 7055623, 7055624, 7055625 Original log message: Adding full bibliography for 7055617--7055625.cif. |
7055617.cif |
| 183408 | 2016-06-11 | cif/ Adding structures of 7055617, 7055618, 7055619, 7055620, 7055621, 7055622, 7055623, 7055624, 7055625 via cif-deposit CGI script. |
7055617.cif |
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