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Information card for entry 1572095
Preview
| Coordinates | 1572095.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C114 H136 Cu2 I4 N8 O18 |
|---|---|
| Calculated formula | C102 H103.996 Cu2 I4 N4 O11.998 |
| Title of publication | Accurate construction of monolayer, bilayer, sandwich bilayer, four-layer, multi-layer and chiral bilayer 2D pillararene-type supramolecular networks. |
| Authors of publication | Chen, Zhao-Nian; Zhang, Le-Ping; Wu, Huai-Li; Qi, Qiao-Yan; Yan, Meng; Tian, Jia; Yang, Guan-Yu; Li, Zhan-Ting; Yang, Bo |
| Journal of publication | Chemical science |
| Year of publication | 2024 |
| Journal volume | 15 |
| Journal issue | 33 |
| Pages of publication | 13191 - 13200 |
| a | 13.7025 ± 0.0003 Å |
| b | 22.6702 ± 0.0005 Å |
| c | 41.6085 ± 0.001 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 12925.2 ± 0.5 Å3 |
| Cell temperature | 193 K |
| Ambient diffraction temperature | 193 K |
| Number of distinct elements | 6 |
| Space group number | 48 |
| Hermann-Mauguin space group symbol | P n n n :2 |
| Hall space group symbol | -P 2ab 2bc |
| Residual factor for all reflections | 0.1716 |
| Residual factor for significantly intense reflections | 0.1319 |
| Weighted residual factors for significantly intense reflections | 0.3146 |
| Weighted residual factors for all reflections included in the refinement | 0.3384 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.142 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 294473 (current) | 2024-09-06 | cif/ Updating files of 1572083, 1572084, 1572085, 1572086, 1572087, 1572088, 1572089, 1572090, 1572091, 1572092, 1572093, 1572094, 1572095, 1572096, 1572097, 1572098, 1572099, 1572100 Original log message: Adding full bibliography for 1572083--1572100.cif. |
1572095.cif |
| 293306 | 2024-07-09 | cif/ Adding structures of 1572083, 1572084, 1572085, 1572086, 1572087, 1572088, 1572089, 1572090, 1572091, 1572092, 1572093, 1572094, 1572095, 1572096, 1572097, 1572098, 1572099, 1572100 via cif-deposit CGI script. |
1572095.cif |
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Users of the data should acknowledge the original authors of the
structural data.