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Information card for entry 7241050
Preview
| Coordinates | 7241050.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C12 H6 N3 O5 Zn |
|---|---|
| Calculated formula | C12 H6 N3 O5 Zn |
| Title of publication | Structural tuning of Zn(ii)-MOFs based on pyrazole functionalized carboxylic acid ligands for organic dye adsorption |
| Authors of publication | Liu, Xiao-Ting; Chen, Si-Si; Li, Si-Miao; Nie, Hong-Xiang; Feng, Yao-Qing; Fan, Yi-Ning; Yu, Mei-Hui; Chang, Ze; Bu, Xian-He |
| Journal of publication | CrystEngComm |
| Year of publication | 2020 |
| a | 13.338 ± 0.003 Å |
| b | 23.519 ± 0.005 Å |
| c | 19.056 ± 0.004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 5978 ± 2 Å3 |
| Cell temperature | 113.15 K |
| Ambient diffraction temperature | 113.15 K |
| Number of distinct elements | 5 |
| Space group number | 60 |
| Hermann-Mauguin space group symbol | P b c n |
| Hall space group symbol | -P 2n 2ab |
| Residual factor for all reflections | 0.0831 |
| Residual factor for significantly intense reflections | 0.0724 |
| Weighted residual factors for significantly intense reflections | 0.2159 |
| Weighted residual factors for all reflections included in the refinement | 0.229 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.1 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 255280 (current) | 2020-08-13 | cif/ Adding structures of 7241050, 7241051 via cif-deposit CGI script. |
7241050.cif |
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Users of the data should acknowledge the original authors of the
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