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Information card for entry 4003296
Preview
| Coordinates | 4003296.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C29.33 H26.67 Cu1.33 N5.33 O8 S2.67 |
|---|---|
| Calculated formula | C29.3333 H26.6667 Cu1.33333 N5.33333 O8 S2.66667 |
| Title of publication | A Robust Sulfonate-Based Metal‒Organic Framework with Permanent Porosity for Efficient CO2 Capture and Conversion |
| Authors of publication | Zhang, Guiyang; Wei, Guangfeng; Liu, Zhipan; Oliver, Scott R. J.; Fei, Honghan |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2016 |
| Journal volume | 28 |
| Journal issue | 17 |
| Pages of publication | 6276 |
| a | 22.28 ± 0.02 Å |
| b | 22.2 ± 0.02 Å |
| c | 11.198 ± 0.01 Å |
| α | 90° |
| β | 90.931 ± 0.008° |
| γ | 90° |
| Cell volume | 5538 ± 9 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 5 |
| Hermann-Mauguin space group symbol | C 1 2 1 |
| Hall space group symbol | C 2y |
| Residual factor for all reflections | 0.0444 |
| Residual factor for significantly intense reflections | 0.0371 |
| Weighted residual factors for significantly intense reflections | 0.0916 |
| Weighted residual factors for all reflections included in the refinement | 0.0951 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 231500 (current) | 2019-11-22 | cif/ Adding structures of 4003296 via cif-deposit CGI script. |
4003296.cif |
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Users of the data should acknowledge the original authors of the
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