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Information card for entry 7160495
Preview
| Coordinates | 7160495.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C41 H30 O2 P |
|---|---|
| Calculated formula | C41 H30 O2 P |
| Title of publication | Base-Promoted Regio- and Diastereoselective Synthesis of Tri- and Tetra-substituted Homoallenyl Phosphine Oxides via Alkynyl Enones |
| Authors of publication | Zhou, Shaochan; Zou, Haotian; Huang, Xianqiang; Qi, Jialin; Xu, Zhenghu |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 10.006 ± 0.012 Å |
| b | 12.706 ± 0.016 Å |
| c | 13.425 ± 0.016 Å |
| α | 75.18 ± 0.04° |
| β | 71.99 ± 0.03° |
| γ | 75.35 ± 0.04° |
| Cell volume | 1541 ± 3 Å3 |
| Cell temperature | 296.15 K |
| Ambient diffraction temperature | 296.15 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 | 0.1452 |
| Residual factor for significantly intense reflections | 0.0867 |
| Weighted residual factors for significantly intense reflections | 0.1955 |
| Weighted residual factors for all reflections included in the refinement | 0.2341 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 299248 (current) | 2025-04-10 | cif/ Adding structures of 7160494, 7160495 via cif-deposit CGI script. |
7160495.cif |
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Users of the data should acknowledge the original authors of the
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