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Information card for entry 4033239
Preview
| Coordinates | 4033239.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C120 H136 O26 S8 |
|---|---|
| Calculated formula | C120 H136 O26 S8 |
| Title of publication | Synthesis and Structure of Feet-to-Feet Connected Bisresorcinarenes. |
| Authors of publication | Shimoyama, Daisuke; Ikeda, Toshiaki; Sekiya, Ryo; Haino, Takeharu |
| Journal of publication | The Journal of organic chemistry |
| Year of publication | 2017 |
| Journal volume | 82 |
| Journal issue | 24 |
| Pages of publication | 13220 - 13230 |
| a | 11.388 ± 0.002 Å |
| b | 14.825 ± 0.003 Å |
| c | 20.643 ± 0.004 Å |
| α | 89.102 ± 0.002° |
| β | 76.622 ± 0.002° |
| γ | 71.446 ± 0.002° |
| Cell volume | 3208 ± 1.1 Å3 |
| Cell temperature | 123 ± 2 K |
| Ambient diffraction temperature | 123 ± 2 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 | 0.1362 |
| Residual factor for significantly intense reflections | 0.0996 |
| Weighted residual factors for significantly intense reflections | 0.2893 |
| Weighted residual factors for all reflections included in the refinement | 0.3194 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.192 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 204797 (current) | 2018-01-06 | cif/ Updating files of 4033235, 4033236, 4033237, 4033238, 4033239 Original log message: Adding full bibliography for 4033235--4033239.cif. |
4033239.cif |
| 203835 | 2017-12-01 | cif/ Adding structures of 4033235, 4033236, 4033237, 4033238, 4033239 via cif-deposit CGI script. |
4033239.cif |
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.
Users of the data should acknowledge the original authors of the
structural data.