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CIF Information Card
Information card for 7052618
7052617 << 7052618 >> 7052619Preview
|
Coordinates |
7052618.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 | 6.6139 ± 0.0007 Å |
| b | 6.9872 ± 0.0007 Å |
| c | 10.4414 ± 0.0011 Å |
| α | 79.736 ± 0.001° |
| β | 82.999 ± 0.001° |
| γ | 75.092 ± 0.001° |
| Cell volume | 457.35 ± 0.08 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Residual factor for all reflections | 0.0327 |
| Residual factor for observed reflections | 0.0292 |
| Weighted residual factors for the observed reflections | 0.067 |
| Weighted residual factors for all reflections included in the refinement | 0.0689 |
| Goodness-of-fit parameter for observed reflections | 1.077 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |