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Information card for entry 1561554
Preview
| Coordinates | 1561554.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H21 N3 O7 Zn |
|---|---|
| Calculated formula | C25 H21 N3 O7 Zn |
| Title of publication | Configurations, band structures and photocurrent responses of 4-(4-oxopyridin-1(4H)-yl)phthalic acid and its metal-organic frameworks |
| Authors of publication | Yan, Xingxiu; Qiu, Xiandeng; Yan, Zhishuo; Li, Hongjiang; Gong, Yun; Lin, Jianhua |
| Journal of publication | Journal of Solid State Chemistry |
| Year of publication | 2016 |
| Journal volume | 237 |
| Pages of publication | 313 - 322 |
| a | 8.718 ± 0.0007 Å |
| b | 10.3129 ± 0.0009 Å |
| c | 14.0421 ± 0.0012 Å |
| α | 72.988 ± 0.001° |
| β | 72.49 ± 0.001° |
| γ | 89.381 ± 0.002° |
| Cell volume | 1147.18 ± 0.17 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0757 |
| Residual factor for significantly intense reflections | 0.0517 |
| Weighted residual factors for significantly intense reflections | 0.1251 |
| Weighted residual factors for all reflections included in the refinement | 0.1365 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.001 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 263971 (current) | 2021-04-08 | cif/ Adding structures of 1561553, 1561554, 1561555, 1561556 via cif-deposit CGI script. |
1561554.cif |
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Users of the data should acknowledge the original authors of the
structural data.