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Information card for entry 7248218
Preview
| Coordinates | 7248218.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C81 H93 Fe3 N12 O24 |
|---|---|
| Calculated formula | C57 H37 Fe3 N4 O16 |
| Title of publication | Synthesis of an iron-based metal–organic framework with octahedral cages for the selective capture of sulfur hexafluoride |
| Authors of publication | Wang, Hao; Shi, Le; Cao, Honghao; Xiong, Zhangyi; Ma, Si; Pan, Jun; Chen, Zhijie |
| Journal of publication | CrystEngComm |
| Year of publication | 2024 |
| Journal volume | 26 |
| Journal issue | 13 |
| Pages of publication | 1912 - 1916 |
| a | 34.238 ± 0.002 Å |
| b | 16.0211 ± 0.0009 Å |
| c | 33.7881 ± 0.0017 Å |
| α | 90° |
| β | 91.078 ± 0.001° |
| γ | 90° |
| Cell volume | 18530.5 ± 1.8 Å3 |
| Cell temperature | 173 K |
| Ambient diffraction temperature | 173 K |
| Number of distinct elements | 5 |
| 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 | 0.0814 |
| Residual factor for significantly intense reflections | 0.0673 |
| Weighted residual factors for significantly intense reflections | 0.1948 |
| Weighted residual factors for all reflections included in the refinement | 0.2118 |
| 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 |
|---|---|---|---|
| 290889 (current) | 2024-04-05 | cif/ Updating files of 7248218 Original log message: Adding full bibliography for 7248218.cif. |
7248218.cif |
| 289945 | 2024-02-24 | cif/ Adding structures of 7248218 via cif-deposit CGI script. |
7248218.cif |
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Users of the data should acknowledge the original authors of the
structural data.