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Information card for entry 7242451
Preview
| Coordinates | 7242451.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H31 Cl N Ni O6 S10 |
|---|---|
| Calculated formula | C20 H31 Cl N Ni O6 S10 |
| Title of publication | Molecular motion of halogenated ethylammonium/[18]crown-6 supramolecular ions in nickel dithiolate magnetic crystals |
| Authors of publication | Hasuo, Naohiro; Takahashi, Kiyonori; Hisaki, Ichiro; Kokado, Kenta; Nakamura, Takayoshi |
| Journal of publication | CrystEngComm |
| Year of publication | 2021 |
| Journal volume | 23 |
| Journal issue | 14 |
| Pages of publication | 2756 - 2763 |
| a | 11.2107 ± 0.0003 Å |
| b | 12.315 ± 0.0002 Å |
| c | 12.7451 ± 0.0003 Å |
| α | 92.2792 ± 0.0018° |
| β | 112.126 ± 0.002° |
| γ | 96.0601 ± 0.0018° |
| Cell volume | 1614.84 ± 0.07 Å3 |
| Cell temperature | 93 K |
| Ambient diffraction temperature | 93 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0608 |
| Residual factor for significantly intense reflections | 0.0495 |
| Weighted residual factors for significantly intense reflections | 0.1395 |
| Weighted residual factors for all reflections included in the refinement | 0.1478 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.098 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
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The link is: https://www.crystallography.net/7242451.html
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