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Information card for entry 7160817
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| Coordinates | 7160817.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H32 O2 S |
|---|---|
| Calculated formula | C25 H32 O2 S |
| Title of publication | Palladium-Catalyzed Asymmetric Propargylic Sulfonylation of Propargyl Esters with Sulfonyl Hydrazides |
| Authors of publication | Wang, Xingwang; Ou, Zhixiong; Song, Jiaxin; zhang, buhong; Li, Libo |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 8.6368 ± 0.0002 Å |
| b | 11.618 ± 0.0003 Å |
| c | 22.8872 ± 0.0006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2296.56 ± 0.1 Å3 |
| Cell temperature | 220 ± 2 K |
| Ambient diffraction temperature | 220 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0461 |
| Residual factor for significantly intense reflections | 0.0381 |
| Weighted residual factors for significantly intense reflections | 0.1115 |
| Weighted residual factors for all reflections included in the refinement | 0.1234 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.878 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 303052 (current) | 2025-10-28 | cif/ Adding structures of 7160817 via cif-deposit CGI script. |
7160817.cif |
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