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Information card for entry 7225206
Preview
| Coordinates | 7225206.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H38 Ag N6 O49 P W12 |
|---|---|
| Calculated formula | C21 H24 Ag N6 O49 P W12 |
| SMILES | c1(NC(=O)C)ccc[n]([Ag][n]2cc(NC(=O)C)ccc2)c1.c1ncc(NC(=O)C)cc1.O=[W]123O[W]45(O[W]67(O[W]89(O[W]%10(O6)(O[W]6%11%12(=O)O[W]%13(O[W]%14(=O)(O%11)(O[W]%11(O[W](O8)(O[W](O9)([O]=P(O%13)(O%14)O%12)(O2)(O5)=O)(O[W](O6)(O%11)(=O)O%10)=O)(O3)=O)O1)(O7)(=O)O4)=O)=O)=O)=O.O.O.O.O.O.O |
| Title of publication | Diverse polyoxometalate-based metal‒organic complexes constructed by a tetrazole- and pyridyl-containing asymmetric amide ligand or its in situ transformed ligand |
| Authors of publication | Wang, Xiu-Li; Rong, Xing; Liu, Dan-Na; Lin, Hong-Yan; Liu, Guo-Cheng; Wang, Xiang; Song, Ge |
| Journal of publication | CrystEngComm |
| Year of publication | 2016 |
| Journal volume | 18 |
| Journal issue | 27 |
| Pages of publication | 5101 |
| a | 12.7322 ± 0.001 Å |
| b | 13.6706 ± 0.0011 Å |
| c | 16.522 ± 0.0014 Å |
| α | 89.582 ± 0.002° |
| β | 87.082 ± 0.002° |
| γ | 86.877 ± 0.002° |
| Cell volume | 2867.7 ± 0.4 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 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 | 0.0981 |
| Residual factor for significantly intense reflections | 0.0722 |
| Weighted residual factors for significantly intense reflections | 0.1954 |
| Weighted residual factors for all reflections included in the refinement | 0.2218 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 206958 (current) | 2018-03-15 | Fixing many Z values and formulae detected when treating files that initially displayed Z' < 1 |
7225206.cif |
| 185230 | 2016-08-07 | cif/ Updating files of 7225203, 7225204, 7225205, 7225206 Original log message: Adding full bibliography for 7225203--7225206.cif. |
7225206.cif |
| 182891 | 2016-05-12 | cif/ Adding structures of 7225203, 7225204, 7225205, 7225206 via cif-deposit CGI script. |
7225206.cif |
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Users of the data should acknowledge the original authors of the
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