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Information card for entry 7242079
Preview
| Coordinates | 7242079.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C60 H72 Br2 O10 |
|---|---|
| Calculated formula | C60 H72 Br2 O10 |
| Title of publication | Concentration-dependent supramolecular self-assembly of A1/A2-asymmetric-difunctionalized pillar[5]arene |
| Authors of publication | Al-Azemi, Talal F.; Vinodh, Mickey |
| Journal of publication | RSC Advances |
| Year of publication | 2021 |
| Journal volume | 11 |
| Journal issue | 5 |
| Pages of publication | 2995 - 3002 |
| a | 38.9455 ± 0.0013 Å |
| b | 12.2323 ± 0.0005 Å |
| c | 24.7957 ± 0.0008 Å |
| α | 90° |
| β | 98.379 ± 0.007° |
| γ | 90° |
| Cell volume | 11686.4 ± 0.8 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.2227 |
| Residual factor for significantly intense reflections | 0.1114 |
| Weighted residual factors for significantly intense reflections | 0.3046 |
| Weighted residual factors for all reflections included in the refinement | 0.3723 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.059 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 260983 (current) | 2021-01-15 | cif/ Adding structures of 7242077, 7242078, 7242079 via cif-deposit CGI script. |
7242079.cif |
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Users of the data should acknowledge the original authors of the
structural data.