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Information card for entry 7710747
Preview
| Coordinates | 7710747.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C22 H16 Cu N4 O4 |
|---|---|
| Calculated formula | C22 H16 Cu N4 O4 |
| Title of publication | Rotation Configuration Control of the sp2 Bond in Diimidazole−dicarboxylate Linker for Isomerism of Porous Coordination Polymers |
| Authors of publication | Duan, Jingui; Dong, Qiubing; Ge, Kai; Zhang, Mingxing; Wang, Huijie |
| Journal of publication | Dalton Transactions |
| Year of publication | 2022 |
| a | 11.3182 ± 0.0004 Å |
| b | 18.1653 ± 0.0011 Å |
| c | 19.1481 ± 0.0009 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3936.8 ± 0.3 Å3 |
| Cell temperature | 190 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0549 |
| Residual factor for significantly intense reflections | 0.0474 |
| Weighted residual factors for significantly intense reflections | 0.1236 |
| Weighted residual factors for all reflections included in the refinement | 0.1264 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.055 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 276838 (current) | 2022-07-23 | cif/ Adding structures of 7710747, 7710748 via cif-deposit CGI script. |
7710747.cif |
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