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Information card for entry 7058181
Preview
| Coordinates | 7058181.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C13 H9 N O5 Zn |
|---|---|
| Calculated formula | C13 H9 N O5 Zn |
| Title of publication | Luminescent metal‒organic frameworks with a 2-(4-pyridyl)-terephthalic acid ligand for detection of acetone |
| Authors of publication | An, Fengqin; Zhang, Chengcheng; Duan, Lijuan; Liu, Xiangyu; Wang, Zheng; Jin, Xiaoyong; Song, Weiming |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2019 |
| Journal volume | 43 |
| Journal issue | 12 |
| Pages of publication | 4800 |
| a | 6.49204 ± 0.00013 Å |
| b | 18.1324 ± 0.0003 Å |
| c | 10.4567 ± 0.0002 Å |
| α | 90° |
| β | 99.4564 ± 0.0019° |
| γ | 90° |
| Cell volume | 1214.2 ± 0.04 Å3 |
| Cell temperature | 150 ± 0.1 K |
| Ambient diffraction temperature | 150 ± 0.1 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0379 |
| Residual factor for significantly intense reflections | 0.0366 |
| Weighted residual factors for significantly intense reflections | 0.0984 |
| Weighted residual factors for all reflections included in the refinement | 0.0996 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.084 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 224990 (current) | 2019-11-08 | cif/ Updating files of 7058181, 7058182, 7058183 Original log message: Adding full bibliography for 7058181--7058183.cif. |
7058181.cif |
| 213717 | 2019-02-20 | cif/ Adding structures of 7058181, 7058182, 7058183 via cif-deposit CGI script. |
7058181.cif |
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Users of the data should acknowledge the original authors of the
structural data.