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Information card for entry 2221453
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| Coordinates | 2221453.cif |
|---|---|
| Structure factors | 2221453.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>catena</i>-Poly[[diaquacobalt(II)]-bis(μ-3-carboxyadamantane-1-carboxylato- κ^2^<i>O</i>^1^:<i>O</i>^3^)] |
|---|---|
| Formula | C24 H34 Co O10 |
| Calculated formula | C24 H34 Co O10 |
| SMILES | [Co]1([OH2])([OH2])OC(=O)C23CC4CC(C2)(CC(C4)C3)C(O)=[O][Co](OC(=O)C23CC4CC(C2)(CC(C4)C3)C(O)=[O]1)([OH2])([OH2])(OC(=O)C12CC3CC(C1)(CC(C3)C2)C(=O)O)[O]=C(O)C12CC3CC(C1)(CC(C3)C2)C(=O)[O-] |
| Title of publication | <i>catena</i>-Poly[[diaquacobalt(II)]-bis(<i>{μ</i>}-3-carboxyadamantane-1-carboxylato-κ^2^<i>O</i>^1^:<i>O</i>^3^)] |
| Authors of publication | Tang, Li-Ming; Xu, Jia-Hui; Han, Xiao-Yan; Xu, Wei |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2009 |
| Journal volume | 65 |
| Journal issue | 4 |
| Pages of publication | m375 |
| a | 10.718 ± 0.002 Å |
| b | 23.638 ± 0.005 Å |
| c | 9.0726 ± 0.0018 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2298.6 ± 0.8 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 56 |
| Hermann-Mauguin space group symbol | P c c n |
| Hall space group symbol | -P 2ab 2ac |
| Residual factor for all reflections | 0.0409 |
| Residual factor for significantly intense reflections | 0.0312 |
| Weighted residual factors for significantly intense reflections | 0.0815 |
| Weighted residual factors for all reflections included in the refinement | 0.0859 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.061 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2221453.html
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Users of the data should acknowledge the original authors of the
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