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Information card for entry 7043923
Preview
| Coordinates | 7043923.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38 H48 Cu2 N4 O16 |
|---|---|
| Calculated formula | C26 H12 Cu2 O10 |
| Title of publication | A Comparative Study of C2H2 Adsorption Properties in Five Isomeric Copper-Based MOFs Based on Naphthalene-Derived Diisophthalates |
| Authors of publication | Chen, Fengli; Bai, Dongjie; Jiang, Donghao; Wang, Yao; He, Yabing |
| Journal of publication | Dalton Trans. |
| Year of publication | 2017 |
| a | 18.315 ± 0.0007 Å |
| b | 18.315 ± 0.0007 Å |
| c | 26.7665 ± 0.0014 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 7775.6 ± 0.6 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 194 |
| Hermann-Mauguin space group symbol | P 63/m m c |
| Hall space group symbol | -P 6c 2c |
| Residual factor for all reflections | 0.1969 |
| Residual factor for significantly intense reflections | 0.1205 |
| Weighted residual factors for significantly intense reflections | 0.3686 |
| Weighted residual factors for all reflections included in the refinement | 0.4127 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.103 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 199629 (current) | 2017-08-08 | cif/ Adding structures of 7043921, 7043922, 7043923, 7043924 via cif-deposit CGI script. |
7043923.cif |
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