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Information card for entry 7228048
Preview
| Coordinates | 7228048.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C54 H34 Cd3 N4 O16 |
|---|---|
| Calculated formula | C54 H34 Cd3 N4 O16 |
| Title of publication | Introducing 2-(2-carboxyphenoxy)terephthalic acid as a new versatile building block for design of diverse coordination polymers: Synthesis, structural features, luminescence sensing, and magnetism |
| Authors of publication | Gu, Jinzhong; Kirillov, Alexander M.; Liang, Xiaoxiao; Cui, Yanhui; Wu, Jiang; Shi, Zi-Fa |
| Journal of publication | CrystEngComm |
| Year of publication | 2017 |
| a | 11.6968 ± 0.0004 Å |
| b | 16.3288 ± 0.0003 Å |
| c | 13.0831 ± 0.0005 Å |
| α | 90° |
| β | 115.442 ± 0.004° |
| γ | 90° |
| Cell volume | 2256.47 ± 0.14 Å3 |
| Cell temperature | 292.8 ± 0.1 K |
| Ambient diffraction temperature | 292.8 ± 0.1 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0461 |
| Residual factor for significantly intense reflections | 0.0356 |
| Weighted residual factors for significantly intense reflections | 0.0721 |
| Weighted residual factors for all reflections included in the refinement | 0.0806 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.997 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7228048.html
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Users of the data should acknowledge the original authors of the
structural data.