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CIF Information Card
Information card for 7205717
7205716 << 7205717 >> 7205718Preview
|
Coordinates |
7205717.cif |
Structure parameters
| Formula | - C26 H28 N14 Ni S2 - |
| Calculated formula | - C26 H28 N14 Ni S2 - |
| 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 | 22.065 ± 0.005 Å |
| b | 13.166 ± 0.003 Å |
| c | 12.255 ± 0.002 Å |
| α | 90° |
| β | 92.379 ± 0.005° |
| γ | 90° |
| Cell volume | 3557.1 ± 1.3 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | C 1 2/c 1 |
| Hall symmetry space group | -C 2yc |
| Residual factor for all reflections | 0.0916 |
| Residual factor for observed reflections | 0.0577 |
| Weighted residual factors for the observed reflections | 0.1611 |
| Weighted residual factors for all reflections included in the refinement | 0.1776 |
| Goodness-of-fit parameter for observed reflections | 0.954 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |