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Information card for entry 7129604
Preview
| Coordinates | 7129604.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C67 H64 Cl4 O20 |
|---|---|
| Calculated formula | C67 H64 Cl4 O20 |
| Title of publication | Rim-Differentiated Pillar[5]arene Based Nonporous Adaptive Crystals |
| Authors of publication | Yao, Yong; Lu, Bing; Yan, Xin; Wang, Jian; Jing, Danni; Bei, Jiali; Cai, Yan |
| Journal of publication | Chemical Communications |
| Year of publication | 2022 |
| a | 19.3459 ± 0.0007 Å |
| b | 15.9668 ± 0.0006 Å |
| c | 21.2957 ± 0.0008 Å |
| α | 90° |
| β | 95.564 ± 0.003° |
| γ | 90° |
| Cell volume | 6547.1 ± 0.4 Å3 |
| Cell temperature | 140 ± 2 K |
| Ambient diffraction temperature | 140 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0985 |
| Residual factor for significantly intense reflections | 0.0673 |
| Weighted residual factors for significantly intense reflections | 0.1752 |
| Weighted residual factors for all reflections included in the refinement | 0.2049 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 272204 (current) | 2022-01-23 | cif/ Adding structures of 7129604 via cif-deposit CGI script. |
7129604.cif |
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