Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2205610
Preview
Coordinates | 2205610.cif |
---|---|
Structure factors | 2205610.hkl |
Original IUCr paper | HTML |
Chemical name | Octapotassium di-μ-sulfato-κ^2^O:O'-bis[cis-dioxo-cis-disulfatotungstate(VI)] |
---|---|
Formula | K8 O28 S6 W2 |
Calculated formula | K8 O28 S6 W2 |
SMILES | [W]1(=O)(=O)(OS(=O)(=O)[O-])(OS(=O)(=O)O[W](=O)(=O)(OS(O1)(=O)=O)(OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+] |
Title of publication | Potassium bis(μ-sulfato-1κ<i>O</i>:2κ<i>O</i>')bis[<i>cis</i>-dioxido-<i>cis</i>-bis(sulfato-κ<i>O</i>)tungstate(VI)] |
Authors of publication | Susan J. Cline Schäffer; Rolf W. Berg |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2005 |
Journal volume | 61 |
Journal issue | 4 |
Pages of publication | i49 - i51 |
a | 9.4362 ± 0.0005 Å |
b | 13.9625 ± 0.0007 Å |
c | 10.1948 ± 0.0005 Å |
α | 90° |
β | 90.78 ± 0.001° |
γ | 90° |
Cell volume | 1343.07 ± 0.12 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 4 |
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 | 0.0136 |
Residual factor for significantly intense reflections | 0.0132 |
Weighted residual factors for significantly intense reflections | 0.0309 |
Weighted residual factors for all reflections included in the refinement | 0.0311 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.125 |
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/2205610.html
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.