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Information card for entry 4033235
Preview
| Coordinates | 4033235.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C92 H111 N3 O19 |
|---|---|
| Calculated formula | C92 H111 N3 O19 |
| 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 | 21.191 ± 0.015 Å |
| b | 32.62 ± 0.02 Å |
| c | 19.973 ± 0.014 Å |
| α | 90° |
| β | 113.248 ± 0.007° |
| γ | 90° |
| Cell volume | 12685 ± 15 Å3 |
| Cell temperature | 123 ± 2 K |
| Ambient diffraction temperature | 123 ± 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 | 0.1691 |
| Residual factor for significantly intense reflections | 0.1341 |
| Weighted residual factors for significantly intense reflections | 0.3574 |
| Weighted residual factors for all reflections included in the refinement | 0.3784 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
| 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. |
4033235.cif |
| 203835 | 2017-12-01 | cif/ Adding structures of 4033235, 4033236, 4033237, 4033238, 4033239 via cif-deposit CGI script. |
4033235.cif |
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Users of the data should acknowledge the original authors of the
structural data.