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Information card for entry 1558876
Preview
| Coordinates | 1558876.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C49.2 H46.78 N3.4 O18.7 Zn3 |
|---|---|
| Calculated formula | C48.8 H42 N3.2 O18.1 Zn3 |
| Title of publication | Inclusion of viologen cations leads to switchable metal-organic frameworks. |
| Authors of publication | Cadman, Laura K.; Mahon, Mary F.; Burrows, Andrew D. |
| Journal of publication | Faraday discussions |
| Year of publication | 2021 |
| Journal volume | 225 |
| Pages of publication | 414 - 430 |
| a | 32.6406 ± 0.0006 Å |
| b | 9.63384 ± 0.00016 Å |
| c | 18.4404 ± 0.0004 Å |
| α | 90° |
| β | 102.534 ± 0.002° |
| γ | 90° |
| Cell volume | 5660.47 ± 0.19 Å3 |
| Cell temperature | 150.01 ± 0.1 K |
| Ambient diffraction temperature | 150.01 ± 0.1 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 | 0.0698 |
| Residual factor for significantly intense reflections | 0.0568 |
| Weighted residual factors for significantly intense reflections | 0.1495 |
| Weighted residual factors for all reflections included in the refinement | 0.1597 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 261709 (current) | 2021-02-05 | cif/ Updating files of 1558875, 1558876, 1558877, 1558878 Original log message: Adding full bibliography for 1558875--1558878.cif. |
1558876.cif |
| 255472 | 2020-08-20 | cif/ Adding structures of 1558875, 1558876, 1558877, 1558878 via cif-deposit CGI script. |
1558876.cif |
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Users of the data should acknowledge the original authors of the
structural data.