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Information card for entry 4347391
Preview
Coordinates | 4347391.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | As2 H64 Na0.75 O102 Rb9.25 Sb4 W18 |
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Calculated formula | As2 H4 O85 Rb10 Sb4 W18 |
SMILES | [Sb]12(O)=[O][W]345(O[W]678(O[W]9%10(O3)(O[W]3%11%12(O[W]%13%14(O6)(O[W]6%15(O3)(O[W]3%16(O[W]%17(O7)(O%13)(O[W](O4)(O3)([O]5=[As]([O]9%11)([O]6%16)[O]8%14%17)(O1)=O)=O)([O]=[Sb]1(O)O[W]345(O[W]678(O[W]9%11(O3)(O[W]3%13%14(O[W]%16(O4)(O[W]4(O3)(O[W]3%17(O[W]%18(O9)(O%13)(O[W](O6)(O3)([O]7[As]([O]5%16)([O]4%17)[O]%11%14%18)([O]=[Sb](O%15)(O)O8)=O)=O)([O]=[Sb](O%10)(O%12)O)=O)(O2)=O)(O1)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O.[Rb+].[Rb+].[Rb+].[Rb+].[Rb+].O.O.O.O.O.O.O.[Rb+].[Rb+].[Rb+].[Rb+].[Rb+].O.O.O.O.O.O |
Title of publication | Tetra-Antimony(III)-Bridged 18-Tungsto-2-Arsenates(V), [(LSb(III))4(A-α-As(V)W9O34)2](10-) (L = Ph, OH): Turning Bioactivity On and Off by Ligand Substitution. |
Authors of publication | Yang, Peng; Lin, Zhengguo; Bassil, Bassem S.; Alfaro-Espinoza, Gabriela; Ullrich, Matthias S.; Li, Ming-Xing; Silvestru, Cristian; Kortz, Ulrich |
Journal of publication | Inorganic chemistry |
Year of publication | 2016 |
Journal volume | 55 |
Journal issue | 8 |
Pages of publication | 3718 - 3720 |
a | 12.5851 ± 0.0015 Å |
b | 18.547 ± 0.003 Å |
c | 17.66 ± 0.003 Å |
α | 90° |
β | 102.982 ± 0.006° |
γ | 90° |
Cell volume | 4016.8 ± 1.1 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 7 |
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 | 0.0307 |
Residual factor for significantly intense reflections | 0.0277 |
Weighted residual factors for significantly intense reflections | 0.0885 |
Weighted residual factors for all reflections included in the refinement | 0.0907 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.004 |
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/4347391.html
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