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Information card for entry 1554955
Preview
| Coordinates | 1554955.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C50 H44 F24 N4 P4 |
|---|---|
| Calculated formula | C50 H44 F24 N4 P4 |
| 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 | 13.488 ± 0.003 Å |
| b | 14.281 ± 0.003 Å |
| c | 14.287 ± 0.003 Å |
| α | 90° |
| β | 108.36 ± 0.03° |
| γ | 90° |
| Cell volume | 2611.9 ± 1.1 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0765 |
| Residual factor for significantly intense reflections | 0.0625 |
| Weighted residual factors for significantly intense reflections | 0.1881 |
| Weighted residual factors for all reflections included in the refinement | 0.2002 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.097 |
| Diffraction radiation wavelength | 0.7 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 238236 (current) | 2019-11-24 | cif/ Adding structures of 1554955 via cif-deposit CGI script. |
1554955.cif |
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Users of the data should acknowledge the original authors of the
structural data.