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Information card for entry 1558836
Preview
| Coordinates | 1558836.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C60 H78 Br6 N10 O10 Zn3 |
|---|---|
| Calculated formula | C60 H78 Br6 N10 O10 Zn3 |
| Title of publication | Metal‒organic tube or layered assembly: reversible sheet-to-tube transformation and adaptive recognition |
| Authors of publication | Tian, Jiayue; Liu, Luyao; Zhou, Kang; Hong, Zixiao; Chen, Qihui; Jiang, Feilong; Yuan, Daqiang; Sun, Qingfu; Hong, Maochun |
| Journal of publication | Chemical Science |
| Year of publication | 2020 |
| Journal volume | 11 |
| Journal issue | 36 |
| Pages of publication | 9818 - 9826 |
| a | 33.1022 ± 0.0015 Å |
| b | 13.6273 ± 0.0004 Å |
| c | 16.0057 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 7220.1 ± 0.5 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173.15 K |
| Number of distinct elements | 6 |
| Space group number | 60 |
| Hermann-Mauguin space group symbol | P b c n |
| Hall space group symbol | -P 2n 2ab |
| Residual factor for all reflections | 0.0829 |
| Residual factor for significantly intense reflections | 0.0661 |
| Weighted residual factors for significantly intense reflections | 0.1293 |
| Weighted residual factors for all reflections included in the refinement | 0.1365 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.158 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
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