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Information card for entry 4134891
Preview
| Coordinates | 4134891.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H31 Cu N2 O10 |
|---|---|
| Calculated formula | C32 H31 Cu N2 O10 |
| Title of publication | Metal-Organic Frameworks with Hexakis(4-carboxyphenyl)benzene - Extensions to Reticular Chemistry and Introducing Foldable Nets. |
| Authors of publication | Amombo Noa, Francoise M.; Svensson Grape, Erik; Brülls, Steffen M; Cheung, Ocean; Malmberg, Per; Inge, A. Ken; McKenzie, Christine J.; Mårtensson, Jerker; Ohrstrom, Lars |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2020 |
| a | 7.9251 ± 0.0009 Å |
| b | 12.738 ± 0.0014 Å |
| c | 16.6928 ± 0.0019 Å |
| α | 74.195 ± 0.003° |
| β | 86.514 ± 0.003° |
| γ | 82.047 ± 0.003° |
| Cell volume | 1605.4 ± 0.3 Å3 |
| Cell temperature | 206 ± 2 K |
| Ambient diffraction temperature | 206 ± 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 | 0.0895 |
| Residual factor for significantly intense reflections | 0.0773 |
| Weighted residual factors for significantly intense reflections | 0.2033 |
| Weighted residual factors for all reflections included in the refinement | 0.2086 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.18 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 251762 (current) | 2020-05-06 | cif/ Adding structures of 4134891 via cif-deposit CGI script. |
4134891.cif |
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Users of the data should acknowledge the original authors of the
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