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Information card for entry 4518741
Preview
| Coordinates | 4518741.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C216.5 H197.5 N18.5 O83 Zn14 |
|---|---|
| Calculated formula | C216.5 H157 N18.5 O83 Zn14 |
| Title of publication | Photocatalytic C-H Activation with Alcohol as a Hydrogen Atom Transfer Agent in a 9-Fluorenone Based Metal-Organic Framework. |
| Authors of publication | Wang, Zhonghe; Zeng, Le; He, Cheng; Duan, Chunying |
| Journal of publication | ACS applied materials & interfaces |
| Year of publication | 2021 |
| a | 29.4226 ± 0.0019 Å |
| b | 44.447 ± 0.004 Å |
| c | 35.326 ± 0.003 Å |
| α | 90° |
| β | 108.777 ± 0.002° |
| γ | 90° |
| Cell volume | 43739 ± 6 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 12 |
| Hermann-Mauguin space group symbol | C 1 2/m 1 |
| Hall space group symbol | -C 2y |
| Residual factor for all reflections | 0.154 |
| Residual factor for significantly intense reflections | 0.0914 |
| Weighted residual factors for significantly intense reflections | 0.2818 |
| Weighted residual factors for all reflections included in the refinement | 0.3249 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.061 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 265585 (current) | 2021-05-29 | cif/ Adding structures of 4518741 via cif-deposit CGI script. |
4518741.cif |
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