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Information card for entry 7220968
Preview
| Coordinates | 7220968.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C15 H11 Br0 Cd N O7 |
|---|---|
| Calculated formula | C15 H11 Cd N O7 |
| Title of publication | Construction of a series of metal‒organic frameworks based on novel flexible ligand 4-carboxy-1-(3,5-dicarboxy-benzyl)-pyridinium chloride and selective d-block metal ions: crystal structures and photoluminescence |
| Authors of publication | Li, Hai-Yang; Cao, Li-Hui; Wei, Yong-Li; Xu, Hong; Zang, Shuang-Quan |
| Journal of publication | CrystEngComm |
| Year of publication | 2015 |
| Journal volume | 17 |
| Journal issue | 33 |
| Pages of publication | 6297 |
| a | 17.0363 ± 0.0004 Å |
| b | 7.7794 ± 0.0002 Å |
| c | 20.1494 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2670.44 ± 0.11 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.0407 |
| Residual factor for significantly intense reflections | 0.0304 |
| Weighted residual factors for significantly intense reflections | 0.0683 |
| Weighted residual factors for all reflections included in the refinement | 0.072 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.089 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176428 (current) | 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. |
7220968.cif |
| 171083 | 2015-12-09 | cif/ Updating files of 7220965, 7220966, 7220967, 7220968, 7220969, 7220970, 7220971 Original log message: Adding full bibliography for 7220965--7220971.cif. |
7220968.cif |
| 139896 | 2015-07-02 | cif/ Adding structures of 7220965, 7220966, 7220967, 7220968, 7220969, 7220970, 7220971 via cif-deposit CGI script. |
7220968.cif |
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Users of the data should acknowledge the original authors of the
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