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Information card for entry 4347291
Preview
| Coordinates | 4347291.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C96 H54 Cu3 F18 N6 O18 |
|---|---|
| Calculated formula | C96 H54 Cu3 F18 N6 O18 |
| Title of publication | Pd@Cu(II)-MOF-Catalyzed Aerobic Oxidation of Benzylic Alcohols in Air with High Conversion and Selectivity. |
| Authors of publication | Chen, Gong-Jun; Wang, Jing-Si; Jin, Fa-Zheng; Liu, Ming-Yang; Zhao, Chao-Wei; Li, Yan-An; Dong, Yu-Bin |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2016 |
| Journal volume | 55 |
| Journal issue | 6 |
| Pages of publication | 3058 - 3064 |
| a | 21.5669 ± 0.0005 Å |
| b | 21.5669 ± 0.0005 Å |
| c | 7.7969 ± 0.0002 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 3140.71 ± 0.13 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 147 |
| Hermann-Mauguin space group symbol | P -3 |
| Hall space group symbol | -P 3 |
| Residual factor for all reflections | 0.1044 |
| Residual factor for significantly intense reflections | 0.0871 |
| Weighted residual factors for significantly intense reflections | 0.2745 |
| Weighted residual factors for all reflections included in the refinement | 0.2433 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.19 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 232247 (current) | 2019-11-23 | cif/ Adding structures of 4347291 via cif-deposit CGI script. |
4347291.cif |
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