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Information card for entry 7134772
Preview
| Coordinates | 7134772.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C27 H20 O3 |
|---|---|
| Calculated formula | C27 H20 O3 |
| Title of publication | Synthesis of functionalized lactones: catalytic cross-coupling of 1,2-diols and allylic alcohols. |
| Authors of publication | Maharana, Priyanka; Sankar, Raman Vijaya; Sankaralingam, Muniyandi; Gunanathan, Chidambaram |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2025 |
| a | 8.4872 ± 0.0004 Å |
| b | 10.3122 ± 0.0005 Å |
| c | 11.7926 ± 0.0005 Å |
| α | 96.838 ± 0.004° |
| β | 107.111 ± 0.004° |
| γ | 99.692 ± 0.004° |
| Cell volume | 956.65 ± 0.08 Å3 |
| Cell temperature | 295.1 ± 0.4 K |
| Ambient diffraction temperature | 295.1 ± 0.4 K |
| Number of distinct elements | 3 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0574 |
| Residual factor for significantly intense reflections | 0.0482 |
| Weighted residual factors for significantly intense reflections | 0.1427 |
| Weighted residual factors for all reflections included in the refinement | 0.151 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.092 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300245 (current) | 2025-06-28 | cif/ Adding structures of 7134772 via cif-deposit CGI script. |
7134772.cif |
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Users of the data should acknowledge the original authors of the
structural data.