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Information card for entry 7223205
Preview
| Coordinates | 7223205.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | 1-CH3OH |
|---|---|
| Formula | C90 H76 Cd5 N6 O28 |
| Calculated formula | C90 H76 Cd5 N6 O28 |
| Title of publication | Instant high-selectivity Cd-MOF chemosensor for naked-eye detection of Cu(ii) confirmed using in situ microcalorimetry |
| Authors of publication | Qiao, Chengfang; Qu, Xiaoni; Yang, Qi; Wei, Qing; Xie, Gang; Chen, Sanping; Yang, Desuo |
| Journal of publication | Green Chem. |
| Year of publication | 2016 |
| Journal volume | 18 |
| Journal issue | 4 |
| Pages of publication | 951 |
| a | 14.583 ± 0.0013 Å |
| b | 23.241 ± 0.002 Å |
| c | 15.6338 ± 0.0014 Å |
| α | 90° |
| β | 106.99 ± 0.002° |
| γ | 90° |
| Cell volume | 5067.4 ± 0.8 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 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 | 0.0801 |
| Residual factor for significantly intense reflections | 0.0563 |
| Weighted residual factors for significantly intense reflections | 0.1619 |
| Weighted residual factors for all reflections included in the refinement | 0.1818 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.071 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 177879 (current) | 2016-03-05 | cif/ Updating files of 7223202, 7223203, 7223204, 7223205 Original log message: Adding full bibliography for 7223202--7223205.cif. |
7223205.cif |
| 176428 | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
7223205.cif |
| 170255 | 2015-11-12 | cif/ Adding structures of 7223202, 7223203, 7223204, 7223205 via cif-deposit CGI script. |
7223205.cif |
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Users of the data should acknowledge the original authors of the
structural data.