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Information card for entry 7239419
Preview
| Coordinates | 7239419.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C16 H18 Cd N10 O |
|---|---|
| Calculated formula | C16 H18 Cd N10 O |
| Title of publication | Mixed azide and substituted 1,2,4-triazole co-ligand bridged 1D chain cadmium(ii) motif: crystal structure, Hirshfeld surfaces and spectroscopic studies |
| Authors of publication | Luo, Yang-Hui; Wu, Dong-En; Ge, Shu-Wang; Li, Yuan; Sun, Bai-Wang |
| Journal of publication | RSC Advances |
| Year of publication | 2014 |
| Journal volume | 4 |
| Journal issue | 23 |
| Pages of publication | 11698 |
| a | 6.8829 ± 0.0014 Å |
| b | 10.916 ± 0.002 Å |
| c | 13.941 ± 0.003 Å |
| α | 101.31 ± 0.03° |
| β | 103.97 ± 0.03° |
| γ | 96.41 ± 0.03° |
| Cell volume | 982.7 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.0755 |
| Residual factor for significantly intense reflections | 0.0576 |
| Weighted residual factors for significantly intense reflections | 0.1528 |
| Weighted residual factors for all reflections included in the refinement | 0.1661 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.09 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 244694 (current) | 2019-11-28 | cif/ Adding structures of 7239419 via cif-deposit CGI script. |
7239419.cif |
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Users of the data should acknowledge the original authors of the
structural data.