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Information card for entry 1564900
Preview
| Coordinates | 1564900.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C39 H34 Cu N2 O9 S4 |
|---|---|
| Calculated formula | C39 H34 Cu N2 O9 S4 |
| Title of publication | Coordination-Bond-Directed Synthesis of Hydrogen-bonded Organic Frameworks from Metal–Organic Frameworks as Templates |
| Authors of publication | Su, Jian; Yuan, Shuai; Cheng, Yi-Xun; Yang, Zhi-Mei; Zuo, Jing-Lin |
| Journal of publication | Chemical Science |
| Year of publication | 2021 |
| a | 19.1651 ± 0.0009 Å |
| b | 34.7043 ± 0.0016 Å |
| c | 8.8821 ± 0.0004 Å |
| α | 90° |
| β | 97.583 ± 0.001° |
| γ | 90° |
| Cell volume | 5855.9 ± 0.5 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296.15 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0739 |
| Residual factor for significantly intense reflections | 0.0616 |
| Weighted residual factors for significantly intense reflections | 0.2022 |
| Weighted residual factors for all reflections included in the refinement | 0.2154 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.062 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 269889 (current) | 2021-10-12 | cif/ Adding structures of 1564900, 1564901, 1564902 via cif-deposit CGI script. |
1564900.cif |
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Users of the data should acknowledge the original authors of the
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