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CIF Information Card
Information card for 7052615
7052614 << 7052615 >> 7052616Preview
|
Coordinates |
7052615.cif |
Structure parameters
| Formula | - C20 H18 N4 Ni O6 - |
| Calculated formula | - C20 H18 N4 Ni O6 - |
| Title of publication | Structural diversity and properties of M(ii) phenyl substituted pyrazole carboxylate complexes with 0D-, 1D-, 2D- and 3D frameworks |
| Authors of publication | Gong, Yunnan; Liu, Chongbo; Wen, Huiliang; Yan, Liushui; Xiong, Zhiqiang; Ding, Liang |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2011 |
| Journal volume | 35 |
| Journal issue | 4 |
| Pages of publication | 865 |
| a | 4.8445 ± 0.0009 Å |
| b | 32.906 ± 0.006 Å |
| c | 6.2836 ± 0.0011 Å |
| α | 90° |
| β | 105.406 ± 0.002° |
| γ | 90° |
| Cell volume | 965.7 ± 0.3 Å3 |
| Cell temperature | 292 ± 2 K |
| Ambient diffraction temperature | 292 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P 1 21/n 1 |
| Hall symmetry space group | -P 2yn |
| Residual factor for all reflections | 0.0642 |
| Residual factor for observed reflections | 0.0463 |
| Weighted residual factors for the observed reflections | 0.1088 |
| Weighted residual factors for all reflections included in the refinement | 0.1169 |
| Goodness-of-fit parameter for observed reflections | 1.056 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |