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Information card for entry 2105089
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| Coordinates | 2105089.cif |
|---|---|
| Structure factors | 2105089.hkl |
| Original IUCr paper | HTML |
| Formula | C42 H22 N4 O17 Zn4 |
|---|---|
| Calculated formula | C42 H22 N4 O17 Zn4 |
| Title of publication | Two novel Zn-MOFs: structures and characterization |
| Authors of publication | Zheng, Ran; Han, Lei; Pan, Qinhe; Christensen, Kirsten E.; Ren, Tiezhen |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 2012 |
| Journal volume | 68 |
| Journal issue | 2 |
| Pages of publication | 158 - 163 |
| a | 15.4925 ± 0.0004 Å |
| b | 15.6741 ± 0.0006 Å |
| c | 17.0388 ± 0.0005 Å |
| α | 90° |
| β | 92.353 ± 0.003° |
| γ | 90° |
| Cell volume | 4134.1 ± 0.2 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.1137 |
| Residual factor for significantly intense reflections | 0.0462 |
| Weighted residual factors for significantly intense reflections | 0.066 |
| Weighted residual factors for all reflections included in the refinement | 0.0756 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.822 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
Version history
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Users of the data should acknowledge the original authors of the
structural data.