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Information card for entry 7112164
Preview
| Coordinates | 7112164.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C40 H40 Cd2 N4 O8 |
|---|---|
| Calculated formula | C40 H40 Cd2 N4 O8 |
| Title of publication | Metal-organic frameworks as stationary phases for mixed-mode separation applications |
| Authors of publication | Turner, David R.; Hawes, Chris S.; Batten, Stuart R.; Knowles, Gregory P.; Chaffee, Alan L.; Nolvachai, Yada; Kulsing, Chadin; Marriott, Philip J. |
| Journal of publication | Chem.Commun. |
| Year of publication | 2014 |
| Journal volume | 50 |
| Pages of publication | 3735 |
| a | 21.722 ± 0.004 Å |
| b | 39.084 ± 0.008 Å |
| c | 17.966 ± 0.004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 15253 ± 5 Å3 |
| Cell temperature | 273 K |
| Ambient diffraction temperature | 273.15 K |
| Number of distinct elements | 5 |
| Space group number | 64 |
| Hermann-Mauguin space group symbol | C m c a |
| Hall space group symbol | -C 2ac 2 |
| Residual factor for all reflections | 0.0964 |
| Residual factor for significantly intense reflections | 0.0788 |
| Weighted residual factors for significantly intense reflections | 0.2379 |
| Weighted residual factors for all reflections included in the refinement | 0.2524 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.983 |
| Diffraction radiation wavelength | 0.7108 Å |
| Diffraction radiation type | Synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.