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Information card for entry 7061008
Preview
| Coordinates | 7061008.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Co2 H31 Mo5 N7 O23 |
|---|---|
| Calculated formula | Co2 H21 Mo5 N7 O23 |
| SMILES | [Mo]1234([O]5[Mo]67([O]8[Mo]9%10([O]1[Co]58([NH3])([NH3])[NH3])(O[Mo]1(O3)(O[Mo](O9)(O6)([O]47%101)(=O)=O)(=O)=O)=O)(=[O][Co]([O]=2)([NH3])([NH3])([NH3])[NH3])=O)=O.O.O.O.O.O |
| Title of publication | The role of mono- and dicarboxylic acids in the building of oxomolybdates containing {MoO4}, {Mo2O5}, {Mo2O6}, {Mo3O8}, {Mo5O17}, {Mo5O18}, {Mo8O26}, and {SiMo12O40} units |
| Authors of publication | Kuzman, Dino; Damjanović, Vladimir; Stilinović, Vladimir; Cindrić, Marina; Vrdoljak, Višnja |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2021 |
| Journal volume | 45 |
| Journal issue | 42 |
| Pages of publication | 19764 - 19774 |
| a | 9.3392 ± 0.0004 Å |
| b | 28.0114 ± 0.0009 Å |
| c | 9.6973 ± 0.0004 Å |
| α | 90° |
| β | 102.988 ± 0.004° |
| γ | 90° |
| Cell volume | 2471.95 ± 0.17 Å3 |
| Cell temperature | 169.98 ± 0.1 K |
| Ambient diffraction temperature | 169.98 ± 0.1 K |
| Number of distinct elements | 5 |
| 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 | 0.0673 |
| Residual factor for significantly intense reflections | 0.0623 |
| Weighted residual factors for significantly intense reflections | 0.1458 |
| Weighted residual factors for all reflections included in the refinement | 0.1488 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.078 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 270480 (current) | 2021-11-06 | cif/ Updating files of 7061007, 7061008, 7061009, 7061010, 7061011, 7061012, 7061013 Original log message: Adding full bibliography for 7061007--7061013.cif. |
7061008.cif |
| 269906 | 2021-10-13 | cif/ Adding structures of 7061007, 7061008, 7061009, 7061010, 7061011, 7061012, 7061013 via cif-deposit CGI script. |
7061008.cif |
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Users of the data should acknowledge the original authors of the
structural data.