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CIF Information Card
Information card for 7205718
7205717 << 7205718 >> 7205719Preview
|
Coordinates |
7205718.cif |
Structure parameters
| Formula | - C36 H42 N20 Ni O6 - |
| Calculated formula | - C36 H42 N20 Ni O6 - |
| Title of publication | Self-adaptation of a conformationally flexible yet restricted “piperazine-pyrazine” building block toward the design of coordination polymers |
| Authors of publication | Lee, Chin-Fen; Hsu, Shu-Chun; Chan, Kai-Chao; Nurnabi, Mohammad; Lee, Chung-Chou; Wu, Jing-Yun; Lai, Long-Li; Lu, Kuang-Lieh |
| Journal of publication | CrystEngComm |
| Year of publication | 2011 |
| Journal volume | 13 |
| Journal issue | 8 |
| Pages of publication | 2960 |
| a | 8.2524 ± 0.0003 Å |
| b | 9.4588 ± 0.0003 Å |
| c | 13.392 ± 0.0004 Å |
| α | 94.799 ± 0.001° |
| β | 102.386 ± 0.001° |
| γ | 109.501 ± 0.001° |
| Cell volume | 948.66 ± 0.05 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.0523 |
| Residual factor for observed reflections | 0.039 |
| Weighted residual factors for the observed reflections | 0.1124 |
| Weighted residual factors for all reflections included in the refinement | 0.1171 |
| Goodness-of-fit parameter for observed reflections | 0.686 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |