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Information card for entry 2001363
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Coordinates | 2001363.cif |
---|---|
Original IUCr paper | HTML |
Common name | Tripotassium Tetrasodium Digydrogen Decatungstogadolinate 21 Hydrate |
---|---|
Formula | Gd H44 K3 Na4 O57 W10 |
Calculated formula | Gd K3 Na4 O57 W10 |
SMILES | [W]1234(=O)O[W]567(=O)O[W]89(O1)(=O)O[W]1%10(O2)(=O)O[W](O3)(=O)(O5)([O]4681)=[O][Gd]123([O]=7)([O]=9)([O]=%10)[O]=[W]456(=O)O[W]78(=[O]1)(=O)O[W]19(=[O]2)(=O)O[W]2(=[O]3)(=O)(O4)[O]571[W](O6)(O8)(O9)(O2)=O.[K+].[K+].[K+].[Na+].[Na+].[Na+].[Na+].O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O |
Title of publication | Structure of K~3~Na~4~H~2~[GdW~10~O~36~].21H~2~O |
Authors of publication | Yamase, T.; Ozeki, T. |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 1993 |
Journal volume | 49 |
Journal issue | 9 |
Pages of publication | 1577 - 1580 |
a | 29.92 ± 0.005 Å |
b | 16.103 ± 0.005 Å |
c | 11.449 ± 0.003 Å |
α | 90° |
β | 96.36 ± 0.01° |
γ | 90° |
Cell volume | 5482 ± 2 Å3 |
Cell temperature | 298.15 K |
Ambient diffraction temperature | 298.15 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 significantly intense reflections | 0.0585 |
Weighted residual factors for significantly intense reflections | 0.0519 |
Goodness-of-fit parameter for significantly intense reflections | 2.152 |
Diffraction radiation wavelength | 0.71069 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/2001363.html
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Users of the data should acknowledge the original authors of the
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