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Information card for entry 7235903
Preview
| Coordinates | 7235903.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C52 H67 N O12 |
|---|---|
| Calculated formula | C52 H67 N O12 |
| Title of publication | Aromatic N-oxide templates open inclusion and dimeric capsular assemblies with methylresorcinarene |
| Authors of publication | Beyeh, Ngong Kodiah; Puttreddy, Rakesh; Rissanen, Kari |
| Journal of publication | RSC Advances |
| Year of publication | 2015 |
| Journal volume | 5 |
| Journal issue | 38 |
| Pages of publication | 30222 |
| a | 12.143 ± 0.002 Å |
| b | 12.791 ± 0.003 Å |
| c | 18.158 ± 0.004 Å |
| α | 95.58 ± 0.03° |
| β | 106.88 ± 0.03° |
| γ | 113.4 ± 0.03° |
| Cell volume | 2403.2 ± 1.3 Å3 |
| Cell temperature | 170 K |
| Ambient diffraction temperature | 170 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1494 |
| Residual factor for significantly intense reflections | 0.0724 |
| Weighted residual factors for significantly intense reflections | 0.1222 |
| Weighted residual factors for all reflections included in the refinement | 0.1485 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301866 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure. |
7235903.cif |
| 233744 | 2019-11-23 | cif/ Adding structures of 7235902, 7235903 via cif-deposit CGI script. |
7235903.cif |
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Users of the data should acknowledge the original authors of the
structural data.