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Information card for entry 4517551
Preview
| Coordinates | 4517551.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C280 H198 N2 O56 Zr6 |
|---|---|
| Calculated formula | C280 H198 N2 O54 Zr4 |
| Title of publication | Building Conjugated Donor-Acceptor Cross-Links into Metal-Organic Frameworks for Photo- and Electroactivity. |
| Authors of publication | Cheng, Shengxian; Li, Kedi; Hu, Jieying; He, Jun; Zeller, Matthias; Xu, Zhengtao |
| Journal of publication | ACS applied materials & interfaces |
| Year of publication | 2020 |
| a | 24.7582 ± 0.0014 Å |
| b | 24.7582 ± 0.0014 Å |
| c | 31.9322 ± 0.0019 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 19573 ± 2 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 128 |
| Hermann-Mauguin space group symbol | P 4/m n c |
| Hall space group symbol | -P 4 2n |
| Residual factor for all reflections | 0.1043 |
| Residual factor for significantly intense reflections | 0.0933 |
| Weighted residual factors for significantly intense reflections | 0.2745 |
| Weighted residual factors for all reflections included in the refinement | 0.2876 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.09 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 250504 (current) | 2020-04-09 | cif/ Adding structures of 4517551 via cif-deposit CGI script. |
4517551.cif |
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