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Information card for entry 7246181
Preview
| Coordinates | 7246181.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H26 Ag Mo12 N8 O46 P |
|---|---|
| Calculated formula | C26 H26 Ag Mo12 N8 O46 P |
| SMILES | [Ag]1([n]2cn(cc2)c2cc(cc(c2)C(=O)O)n2c[nH+]cc2)([n]2ccn(c2)c2cc(cc(c2)n2cc[nH+]c2)C(=O)O)[O]=[Mo]2345[O]67=P89[O]%10%11[Mo]%12%13%14(O[Mo]%15%16%17([O]%189[Mo]9%19(O[Mo]%18(O%15)(O2)(O[Mo]2%15([O]%188[Mo](O2)(=O)(O%14)(O[Mo]2%18(O[Mo]86(O[Mo]%10(O%12)(=O)(O[Mo]%11(=O)(O%13)(O%19)O[Mo]7(=O)(O9)(O8)O4)O2)(=O)[O]15)(O%15)=O)O%17)(=O)O3)=O)(=O)O%16)=O)=O.O.O |
| Title of publication | Five new multifunctional inorganic–organic hybrids based on Keggin-type polyoxometalates and a 3,5-di(1H-imidazol-1-yl)benzoic acid ligand |
| Authors of publication | Yu, Xiao-Yang; Lv, Yanxin; Weng, Xiaoyu; Geng, Jiaqi; Yang, Yanyan; Jin, Hua; Cui, Hao; Fu, Bo; Qu, Xiaoshu; Shi, Hongfei; Cao, Xueling |
| Journal of publication | CrystEngComm |
| Year of publication | 2023 |
| Journal volume | 25 |
| Journal issue | 15 |
| Pages of publication | 2185 - 2195 |
| a | 13.2416 ± 0.0015 Å |
| b | 13.5875 ± 0.0017 Å |
| c | 16.296 ± 0.002 Å |
| α | 87.365 ± 0.005° |
| β | 74.269 ± 0.004° |
| γ | 88.263 ± 0.005° |
| Cell volume | 2818.7 ± 0.6 Å3 |
| Cell temperature | 147 ± 2 K |
| Ambient diffraction temperature | 147 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 | 0.0503 |
| Residual factor for significantly intense reflections | 0.0357 |
| Weighted residual factors for significantly intense reflections | 0.0747 |
| Weighted residual factors for all reflections included in the refinement | 0.0822 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.051 |
| Diffraction radiation wavelength | 0.71076 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 283220 (current) | 2023-05-05 | cif/ Updating files of 7246180, 7246181, 7246182, 7246183, 7246184 Original log message: Adding full bibliography for 7246180--7246184.cif. |
7246181.cif |
| 280477 | 2023-01-21 | cif/ Adding structures of 7246180, 7246181, 7246182, 7246183, 7246184 via cif-deposit CGI script. |
7246181.cif |
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Users of the data should acknowledge the original authors of the
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