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Information card for entry 7233406
Preview
| Coordinates | 7233406.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H26 Cu N4 O7 |
|---|---|
| Calculated formula | C30 H26 Cu N4 O7 |
| Title of publication | Construction of Cu-based MOFs with enhanced hydrogenation performance by integrating open electropositive metal sites |
| Authors of publication | Zhang, Xiuling; Geng, Longlong; Zhang, Yong-Zheng; Zhang, Da-Shuai; Zhang, Ranhui; Fu, Junna; Gao, Jun; Carozza, Jesse C.; Zhou, Zheng; Han, Haixiang |
| Journal of publication | CrystEngComm |
| Year of publication | 2019 |
| Journal volume | 21 |
| Journal issue | 36 |
| Pages of publication | 5382 |
| a | 10.0881 ± 0.0002 Å |
| b | 10.2574 ± 0.0002 Å |
| c | 14.2782 ± 0.0003 Å |
| α | 76.988 ± 0.002° |
| β | 72.988 ± 0.002° |
| γ | 82.528 ± 0.002° |
| Cell volume | 1373.28 ± 0.05 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 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 | 0.0411 |
| Residual factor for significantly intense reflections | 0.0384 |
| Weighted residual factors for significantly intense reflections | 0.0995 |
| Weighted residual factors for all reflections included in the refinement | 0.1014 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.069 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 223696 (current) | 2019-11-07 | cif/ Updating files of 7233406, 7233407 Original log message: Adding full bibliography for 7233406--7233407.cif. |
7233406.cif |
| 217627 | 2019-08-21 | cif/ Adding structures of 7233406, 7233407 via cif-deposit CGI script. |
7233406.cif |
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Users of the data should acknowledge the original authors of the
structural data.