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Information card for entry 1568019
Preview
| Coordinates | 1568019.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C75 H67 N11 O18 Y2 |
|---|---|
| Calculated formula | C75 H67 N11 O18 Y2 |
| Title of publication | Fluorine Extraction from Organofluorine Molecules to Make Fluorinated Clusters in Yttrium MOFs |
| Authors of publication | Balkus, Kenneth J.; Abbas, Muhammad; Maceda, Amanda M.; Firouzi, Hamid R.; Xiao, Zhifeng; Arman, Hadi; Shi, Yanshu; Zhou, Hong-Cai |
| Journal of publication | Chemical Science |
| Year of publication | 2022 |
| a | 11.8512 ± 0.0012 Å |
| b | 16.2294 ± 0.0016 Å |
| c | 19.309 ± 0.002 Å |
| α | 78.447 ± 0.003° |
| β | 75.155 ± 0.003° |
| γ | 89.692 ± 0.003° |
| Cell volume | 3513 ± 0.6 Å3 |
| Cell temperature | 110 K |
| Ambient diffraction temperature | 110 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0986 |
| Residual factor for significantly intense reflections | 0.0567 |
| Weighted residual factors for significantly intense reflections | 0.1239 |
| Weighted residual factors for all reflections included in the refinement | 0.1439 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 279583 (current) | 2022-11-28 | cif/ Adding structures of 1568019, 1568020 via cif-deposit CGI script. |
1568019.cif |
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Users of the data should acknowledge the original authors of the
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