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CIF Information Card
Information card for 7015536
7015535 << 7015536 >> 7015537Preview
|
Coordinates |
7015536.cif |
Structure parameters
| Formula | - C19 H19 N6 Ni S4 - |
| Calculated formula | - C19 H19 N6 Ni S4 - |
| Title of publication | A low-dimensional molecular spin system with two steps of magnetic transitions and liquid crystal property. |
| Authors of publication | Duan, Hai-Bao; Ren, Xiao-Ming; Shen, Lin-Jiang; Jin, Wan-Qin; Meng, Qing-Jin; Tian, Zheng-Fang; Zhou, Shi-Ming |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2011 |
| Journal volume | 40 |
| Journal issue | 14 |
| Pages of publication | 3622 - 3630 |
| a | 4.454 ± 0.0005 Å |
| b | 13.6238 ± 0.0015 Å |
| c | 20.238 ± 0.002 Å |
| α | 84.472 ± 0.009° |
| β | 85.962 ± 0.008° |
| γ | 82.683 ± 0.009° |
| Cell volume | 1210.3 ± 0.2 Å3 |
| Cell temperature | 105 ± 2 K |
| Ambient diffraction temperature | 105 ± 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 | 0.0591 |
| Residual factor for observed reflections | 0.0442 |
| Weighted residual factors for the observed reflections | 0.1363 |
| Weighted residual factors for all reflections included in the refinement | 0.1401 |
| Goodness-of-fit parameter for observed reflections | 1.226 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |