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Information card for entry 2012979
Preview
| Coordinates | 2012979.cif |
|---|---|
| Original IUCr paper | HTML |
| External links | PubChem |
| Chemical name | Bis(μ-acetato-κ^3^O,O':O')bis[bis(acetato-κ^2^O,O')diaquadysprosium(III)] tetrahydrate |
|---|---|
| Formula | C12 H34 Dy2 O20 |
| Calculated formula | C12 H34 Dy2 O20 |
| SMILES | [Dy]1234(OC(=[O]1)C)([O]=C(C)[O]2[Dy]125(OC(=[O]1)C)([O]=C(C)[O]32)(OC(=[O]5)C)([OH2])[OH2])(OC(=[O]4)C)([OH2])[OH2].O.O.O.O |
| Title of publication | Bis(μ-acetato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>')bis[bis(acetato-κ^2^<i>O</i>,<i>O</i>')diaquadysprosium(III)] tetrahydrate |
| Authors of publication | Baggio, Ricardo; Muñoz, Juan Carlos; Perec, Mireille |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2002 |
| Journal volume | 58 |
| Journal issue | 10 |
| Pages of publication | m498 - m500 |
| a | 8.872 ± 0.001 Å |
| b | 9.249 ± 0.001 Å |
| c | 10.456 ± 0.001 Å |
| α | 91.71 ± 0.01° |
| β | 114.11 ± 0.01° |
| γ | 117.88 ± 0.01° |
| Cell volume | 665.8 ± 0.17 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.041 |
| Residual factor for significantly intense reflections | 0.041 |
| Weighted residual factors for significantly intense reflections | 0.095 |
| Weighted residual factors for all reflections included in the refinement | 0.095 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.057 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2012979.html
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structural data.