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Information card for entry 2020585
Preview
| Coordinates | 2020585.cif |
|---|---|
| Structure factors | 2020585.hkl |
| Original paper (by DOI) | HTML |
| Chemical name | Poly[diaqua(μ~4~-1,4-bis{[1-(pyridin-3-ylmethyl)-1<i>H</i>-benz[<i>d</i>]imidazol-2-yl]methoxy}benzene)bis(μ~2~-isophthalato)dicadmium(II)] |
|---|---|
| Formula | C25 H20 Cd N3 O6 |
| Calculated formula | C25 H20 Cd N3 O6 |
| Title of publication | Two new two-dimensional coordination polymers based on isophthalate and a flexible <i>N</i>-donor ligand containing benzimidazole and pyridine rings: synthesis, crystal structures and a solid-state UV‒Vis study |
| Authors of publication | Hasi, Qi-Meige; Fan, Yan; Hou, Chen; Yao, Xiao-Qiang; Liu, Jia-Cheng |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2016 |
| Journal volume | 72 |
| Journal issue | 10 |
| Pages of publication | 724 - 729 |
| a | 9.9608 ± 0.0008 Å |
| b | 10.548 ± 0.001 Å |
| c | 11.1137 ± 0.0013 Å |
| α | 108.408 ± 0.01° |
| β | 99.712 ± 0.008° |
| γ | 96.218 ± 0.007° |
| Cell volume | 1075.6 ± 0.2 Å3 |
| Cell temperature | 294.77 ± 0.1 K |
| Ambient diffraction temperature | 294.77 ± 0.1 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 | 0.0516 |
| Residual factor for significantly intense reflections | 0.0415 |
| Weighted residual factors for significantly intense reflections | 0.0844 |
| Weighted residual factors for all reflections included in the refinement | 0.0925 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.018 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 187987 (current) | 2016-11-06 | cif/ Updating files of 2020584, 2020585 Original log message: Adding full bibliography for 2020584--2020585.cif. |
2020585.cif 2020585.hkl |
| 186168 | 2016-09-06 | cif/ hkl/ Adding structures of 2020584, 2020585 via cif-deposit CGI script. |
2020585.cif 2020585.hkl |
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Users of the data should acknowledge the original authors of the
structural data.