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Information card for entry 7225205
Preview
| Coordinates | 7225205.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H46 Ag4 Mo24 N24 O90 P2 |
|---|---|
| Calculated formula | C32 H32 Ag4 Mo24 N24 O90 P2 |
| SMILES | c1[n]2[Ag][n]3cn(n[n]3[Ag]([n]3[n](cn(CC(=O)Nc4cccnc4)n3)[Ag][n]3cn(n[n]3[Ag]([n]2nn1CC(=O)Nc1cccnc1)([O]=[Mo]1234[O]56=P78[O]9%10[Mo]%11%12%13(=O)O[Mo]%14%15%16([O]%177[Mo]7%18(O[Mo]%19%17(=O)(O[Mo]%17%20([O]%218[Mo]8(O%18)(O%17)(=O)O[Mo]%21(=O)(O3)(O%20)O[Mo]9(=O)(O4)(O[Mo]%10(O7)(=O)(O%12)O8)O%13)(=O)O[Mo]5(=O)(O%19)(O[Mo]6(=O)(O%11)(O%16)O1)O2)O%15)(=O)O%14)=O)[OH2])CC(=O)Nc1cnccc1)([O]=[Mo]1234[O]56=P78[O]9%10[Mo]%11%12(=O)(O[Mo]%13%14([O]%158[Mo]8%16(=O)(O%14)O[Mo]%14%17%18(=O)[O]%197[Mo]7%20(O%14)(=O)O[Mo]9(=O)(O[Mo]9%10(=O)(O[Mo]%19(=O)(O%20)(O%17)O[Mo]6(=O)(O9)(O3)O[Mo]5(=O)(O%18)(O%16)O4)O%12)(O%11)O[Mo]%15(=O)(O%13)(O7)O8)(=O)O1)O2)[OH2])CC(=O)Nc1cnccc1.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 | 12.932 ± 0.0004 Å |
| b | 18.982 ± 0.0006 Å |
| c | 21.457 ± 0.0007 Å |
| α | 90° |
| β | 102.729 ± 0.001° |
| γ | 90° |
| Cell volume | 5137.7 ± 0.3 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 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 | 0.0523 |
| Residual factor for significantly intense reflections | 0.0486 |
| Weighted residual factors for significantly intense reflections | 0.1104 |
| Weighted residual factors for all reflections included in the refinement | 0.1121 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 185230 (current) | 2016-08-07 | cif/ Updating files of 7225203, 7225204, 7225205, 7225206 Original log message: Adding full bibliography for 7225203--7225206.cif. |
7225205.cif |
| 182891 | 2016-05-12 | cif/ Adding structures of 7225203, 7225204, 7225205, 7225206 via cif-deposit CGI script. |
7225205.cif |
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Users of the data should acknowledge the original authors of the
structural data.