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Information card for entry 7242918
Preview
| Coordinates | 7242918.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C60 H36 Co4 F3 N15 O10 S |
|---|---|
| Calculated formula | C60 H36 Co4 F3 N15 O10 S |
| Title of publication | A highly stable metal‒organic framework with cubane-like clusters for the selective oxidation of aryl alkenes to aldehydes or ketones |
| Authors of publication | Liu, Teng; Shen, Xianfu; Shen, Xiang; He, Chixian; Liu, Jiaming; Liu, Jian-Jun |
| Journal of publication | CrystEngComm |
| Year of publication | 2021 |
| Journal volume | 23 |
| Journal issue | 26 |
| Pages of publication | 4667 - 4673 |
| a | 23.6033 ± 0.0008 Å |
| b | 23.6033 ± 0.0008 Å |
| c | 23.6033 ± 0.0008 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 13149.8 ± 0.8 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 198 |
| Hermann-Mauguin space group symbol | P 21 3 |
| Hall space group symbol | P 2ac 2ab 3 |
| Residual factor for all reflections | 0.0611 |
| Residual factor for significantly intense reflections | 0.0394 |
| Weighted residual factors for significantly intense reflections | 0.0842 |
| Weighted residual factors for all reflections included in the refinement | 0.0908 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.002 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 268658 (current) | 2021-09-06 | cif/ Updating files of 7242918 Original log message: Adding full bibliography for 7242918.cif. |
7242918.cif |
| 265515 | 2021-05-27 | cif/ Adding structures of 7242918 via cif-deposit CGI script. |
7242918.cif |
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Users of the data should acknowledge the original authors of the
structural data.