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Information card for entry 7240961
Preview
| Coordinates | 7240961.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C51.5 H67.5 Cu4 N6.5 O27.5 |
|---|---|
| Calculated formula | C41 H41 Cu4 N3 O23 |
| Title of publication | Construction and selective gas adsorption properties of two heteroSBU MOFs based on unsymmetrical tetracarboxylate linkers |
| Authors of publication | Xu, Tingting; Fan, Lihui; Zhou, Ping; Jiang, Zhenzhen; Chen, Haonan; Lu, Huangyan; He, Yabing |
| Journal of publication | CrystEngComm |
| Year of publication | 2020 |
| a | 19.3334 ± 0.001 Å |
| b | 25.6921 ± 0.0012 Å |
| c | 15.8595 ± 0.0013 Å |
| α | 90° |
| β | 123.08 ± 0.002° |
| γ | 90° |
| Cell volume | 6600.8 ± 0.7 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 12 |
| Hermann-Mauguin space group symbol | C 1 2/m 1 |
| Hall space group symbol | -C 2y |
| Residual factor for all reflections | 0.0524 |
| Residual factor for significantly intense reflections | 0.0482 |
| Weighted residual factors for significantly intense reflections | 0.203 |
| Weighted residual factors for all reflections included in the refinement | 0.2133 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.077 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 254637 (current) | 2020-07-29 | cif/ Adding structures of 7240961, 7240962 via cif-deposit CGI script. |
7240961.cif |
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Users of the data should acknowledge the original authors of the
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