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Information card for entry 1550624
Preview
| Coordinates | 1550624.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C56 H60 F20 K O11 P |
|---|---|
| Calculated formula | C56 H60 F20 K O11 P |
| Title of publication | Synthesis and characterization of a pair of O-fac/O-mer 12-P-6 alkyloxaphosphates with a P-O-C-C four-membered ring |
| Authors of publication | Jiang, Xin-Dong; Toya, Yuya; Matsukawa, Shiro; Kojima, Satoshi; Jimenez-Halla, Jose Oscar Carlos; Shang, Rong; Nakamoto, Masaaki; Yamamoto, Yohsuke |
| Journal of publication | Chemical Science |
| Year of publication | 2019 |
| a | 11.03 ± 0.002 Å |
| b | 12.802 ± 0.003 Å |
| c | 23.276 ± 0.005 Å |
| α | 105.47 ± 0.002° |
| β | 92.07 ± 0.003° |
| γ | 96.064 ± 0.003° |
| Cell volume | 3142.8 ± 1.2 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0895 |
| Residual factor for significantly intense reflections | 0.0763 |
| Weighted residual factors for significantly intense reflections | 0.2252 |
| Weighted residual factors for all reflections included in the refinement | 0.2361 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.065 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 213711 (current) | 2019-02-20 | cif/ Adding structures of 1550622, 1550623, 1550624, 1550625, 1550626 via cif-deposit CGI script. |
1550624.cif |
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Users of the data should acknowledge the original authors of the
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