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Information card for entry 4133672
Preview
| Coordinates | 4133672.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | COF-300-H2O |
|---|---|
| Formula | C41 H36 N4 O4 |
| Calculated formula | C41 H36 N4 O4 |
| Title of publication | Atomic-Level Characterization of Dynamics of a 3D Covalent Organic Framework by Cryo-Electron Diffraction Tomography. |
| Authors of publication | Sun, Tu; Wei, Lei; Chen, Yichong; Ma, Yanhang; Zhang, Yue-Biao |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2019 |
| Journal volume | 141 |
| Journal issue | 28 |
| Pages of publication | 10962 - 10966 |
| a | 19.9 Å |
| b | 19.9 Å |
| c | 9.3 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3682.89 Å3 |
| Cell temperature | 77 K |
| Ambient diffraction temperature | 77 K |
| Number of distinct elements | 4 |
| Space group number | 88 |
| Hermann-Mauguin space group symbol | I 41/a :2 |
| Hall space group symbol | -I 4ad |
| Residual factor for all reflections | 0.3074 |
| Residual factor for significantly intense reflections | 0.2911 |
| Weighted residual factors for significantly intense reflections | 0.6091 |
| Weighted residual factors for all reflections included in the refinement | 0.6187 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
| Diffraction radiation wavelength | 0.0251 Å |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 243409 (current) | 2019-11-26 | cif/ Adding structures of 4133672 via cif-deposit CGI script. |
4133672.cif |
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