Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1100735
Preview
Coordinates | 1100735.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | Cl3 Eu H82 K5 O155.5 P4 W34 |
---|---|
Calculated formula | Cl3 Eu K5 O155.5 P4 W34 |
SMILES | [W]1234(=O)O[Eu]56789(O[W]%10%11%12(=O)[O]%13[W]%14%15(=O)(O[W]%16%17%18(=O)[O]%19[W](=O)(O3)(O[W]3%20%21(=O)[O]%22[W]%23(=O)(O%20)(O[W]%20%24(=O)([O]%25[W]%26(=O)(O[W]%27%28(=O)(O6)[O]6[W](=O)(O%27)(O3)(O[W]3%27(=O)([O]%29([W](=O)(O%23)(O%24)(O3)O[W]%29(=O)(O%28)(O%26)O%27)P%22%25=6)O%21)O2)(O%20)O%11)O%14)O%17)(O%16)O[W]23(=O)([O]6([W](=O)(O%18)(O%15)(O2)O[W]6(=O)(O5)(O%12)O3)P%13%19=[O]1)O4)O%10)O[W]123(=O)[O]4[W]56(=O)(O2)O[W]2%10%11(=O)[O]%12[W]%13(=O)(O1)(O[W]1%14(=O)(O9)[O]9[W]%15%16(=O)(O[W]%17%18(=O)(O7)[O]=P74[O]4[W]%19%20(=O)(O5)O[W]5%21(=O)([O]%22[W](=O)(O[W]4(=O)(O%19)(O%17)O[W]4%17(=O)([O]%197[W](=O)(O8)(O3)(O[W]%19(=O)(O6)(O%20)O%17)O4)O%18)(O5)(O%15)O[W]34(=O)([O]5([W](=O)(O%14)(O%13)(O[W]5(=O)(O%11)(O%21)O4)O3)P=%129%22)O%16)O%10)O1)O2.[K+].[K+].[K+].[K+].[K+].[Cl-].[Cl-].[Cl-].O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O |
Title of publication | Influence of Steric and Electronic Properties of the Defect Site, Lanthanide Ionic Radii, and Solution Conditions on the Composition of Lanthanide(III) α1-P2W17O6110-Polyoxometalates |
Authors of publication | Cheng Zhang; Robertha C. Howell; Qun-Hui Luo; Heidi L. Fieselmann; Louis J. Todaro; Lynn C. Francesconi |
Journal of publication | Inorganic Chemistry |
Year of publication | 2005 |
Journal volume | 44 |
Pages of publication | 3569 - 3578 |
a | 16.432 ± 0.003 Å |
b | 21.204 ± 0.004 Å |
c | 25.86 ± 0.005 Å |
α | 88.82 ± 0.03° |
β | 82.32 ± 0.03° |
γ | 69.61 ± 0.03° |
Cell volume | 8367 ± 3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1786 |
Residual factor for significantly intense reflections | 0.1125 |
Weighted residual factors for significantly intense reflections | 0.2761 |
Weighted residual factors for all reflections included in the refinement | 0.3158 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
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/1100735.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.