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Information card for entry 1560781
Preview
| Coordinates | 1560781.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C136 H152 Cd8 N24 O32 |
|---|---|
| Calculated formula | C136 H152 Cd8 N24 O32 |
| Title of publication | Nitroaromatic-detecting zinc and cadmium coordination polymers with methyl-substituted aliphatic dicarboxylate and 4,4′-dipyridylamine ligands and diverse topologies |
| Authors of publication | Contejean, Zaria I.; LaDuca, Robert L. |
| Journal of publication | Journal of Solid State Chemistry |
| Year of publication | 2018 |
| Journal volume | 266 |
| Pages of publication | 44 - 53 |
| a | 20.0114 ± 0.0015 Å |
| b | 24.6279 ± 0.0019 Å |
| c | 28.424 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 14008.4 ± 1.8 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173.15 K |
| Number of distinct elements | 5 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.1326 |
| Residual factor for significantly intense reflections | 0.0688 |
| Weighted residual factors for significantly intense reflections | 0.1494 |
| Weighted residual factors for all reflections included in the refinement | 0.1852 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.028 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 262387 (current) | 2021-03-03 | cif/ Adding structures of 1560781 via cif-deposit CGI script. |
1560781.cif |
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Users of the data should acknowledge the original authors of the
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