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Information card for entry 7057239
Preview
| Coordinates | 7057239.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H51 Fe3 N14 Na3 O73 Sb2 W18 |
|---|---|
| Calculated formula | C13.25 H19.25 Fe3 N10.25 Na3 O71 Sb2 W18 |
| SMILES | O1[W]234(O[W]567([O]82[Sb]2[O]9%10[W]%11%12%13(O[W]%14%10(O[W]%10%15(O[W]%16%17(O%11)(O[W]([O]2%10%16)(=O)(O%15)([O]2[Na]%10%11([O]%17[Fe]%15%16([O]%12[Na]%12%17%18([O]%19[W]9(O[W]18([O]1[Fe]8%19([n]9c[nH]cc9)[O]9[Na]%19%201([O]3[Fe]12([O]%19[W]23%19(O[W]%21%22%23(O[W]%24%25%26(O[W]%27(O2)(O[W]2([O]%24%27[Sb]%24[O]%27%28[W]%29(O[W]%28(O[W]9([O]3%21%24)(=O)([O]%20%19)O%23)([O]%178)(O[W]%27(O%29)(O%22)(=O)O%25)=O)(=O)([O]%16%18)O2)(=O)(O%26)[O]%11%15)(=O)[O]%101)=O)=O)=O)[n]1cc[nH]c1)[OH2])(O7)=O)(=O)([O]%13%12)O%14)[OH2])[n]1cc[nH]c1)([OH2])[OH2])O4)=O)(=O)O6)(O5)=O)=O)=O)=O.[nH]1cc[nH+]c1.[nH]1cc[nH+]c1.O |
| Title of publication | A novel sandwich-tungstoantimonate cluster with FeII ions: synthesis, magnetic property and electrochemical sensing of dopamine |
| Authors of publication | Sun, Minghui; Wang, Tianqi; Li, Fengyan; Sun, Zhixia; Xu, Lin |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2018 |
| Journal volume | 42 |
| Journal issue | 9 |
| Pages of publication | 7480 |
| a | 32.614 ± 0.004 Å |
| b | 15.7648 ± 0.0015 Å |
| c | 25.292 ± 0.003 Å |
| α | 90° |
| β | 111.421 ± 0.003° |
| γ | 90° |
| Cell volume | 12106 ± 2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.1286 |
| Residual factor for significantly intense reflections | 0.0634 |
| Weighted residual factors for significantly intense reflections | 0.1693 |
| Weighted residual factors for all reflections included in the refinement | 0.2061 |
| 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 | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 230447 (current) | 2019-11-17 | cif/ Updating files of 7057239 Original log message: Adding full bibliography for 7057239.cif. |
7057239.cif |
| 207236 | 2018-04-05 | cif/ Adding structures of 7057239 via cif-deposit CGI script. |
7057239.cif |
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Users of the data should acknowledge the original authors of the
structural data.