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Information card for entry 8104802
Preview
| Coordinates | 8104802.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H18 Cd N O7 |
|---|---|
| Calculated formula | C20 H20 Cd N O7 |
| Title of publication | Crystal structure of catena-poly[tetraaqua-(μ2-4,4′-bipyridine-k2 N:N′)-bis(μ2-4′-methyl-[1,1′-biphenyl]-3,5-dicarboxylato-k4 O,O′:O″,O′″)dicadmium(II)] dihydrate, C20H20NO7Cd |
| Authors of publication | Chen, Shi-Jun; Cao, Xin; Ma, Xin-Dong; Xi, Zhong-Chen; Li, Shi-Hui |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2021 |
| Journal volume | 236 |
| Journal issue | 3 |
| Pages of publication | 689 - 691 |
| a | 9.9506 ± 0.0008 Å |
| b | 10.1867 ± 0.0011 Å |
| c | 11.2774 ± 0.0011 Å |
| α | 110.528 ± 0.009° |
| β | 93.83 ± 0.007° |
| γ | 107.307 ± 0.008° |
| Cell volume | 1003.17 ± 0.19 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 | 0.0964 |
| Residual factor for significantly intense reflections | 0.0775 |
| Weighted residual factors for significantly intense reflections | 0.1874 |
| Weighted residual factors for all reflections included in the refinement | 0.2051 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.072 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 273802 (current) | 2022-03-18 | cif/ Adding structures of 8104802 via cif-deposit CGI script. |
8104802.cif |
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Users of the data should acknowledge the original authors of the
structural data.