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Information card for entry 1554956
Preview
| Coordinates | 1554956.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C186 H168 B4 N14 O31 |
|---|---|
| Calculated formula | C186 H168 B4 N14 O31 |
| Title of publication | Nestable Tetrakis(spiroborate) Nanocycles. |
| Authors of publication | Danjo, Hiroshi; Hashimoto, Yuhki; Kidena, Yuki; Nogamine, Ayumi; Katagiri, Kosuke; Kawahata, Masatoshi; Miyazawa, Toshifumi; Yamaguchi, Kentaro |
| Journal of publication | Organic letters |
| Year of publication | 2015 |
| Journal volume | 17 |
| Journal issue | 9 |
| Pages of publication | 2154 - 2157 |
| a | 16.134 ± 0.003 Å |
| b | 16.609 ± 0.003 Å |
| c | 16.766 ± 0.003 Å |
| α | 85.82 ± 0.03° |
| β | 65.15 ± 0.03° |
| γ | 75.26 ± 0.03° |
| Cell volume | 3939.7 ± 1.7 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1734 |
| Residual factor for significantly intense reflections | 0.0878 |
| Weighted residual factors for significantly intense reflections | 0.2443 |
| Weighted residual factors for all reflections included in the refinement | 0.2936 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
| Diffraction radiation wavelength | 0.7 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 238237 (current) | 2019-11-24 | cif/ Adding structures of 1554956 via cif-deposit CGI script. |
1554956.cif |
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Users of the data should acknowledge the original authors of the
structural data.