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Information card for entry 7160435
Preview
| Coordinates | 7160435.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C28 H27 N3 O3 |
|---|---|
| Calculated formula | C28 H27 N3 O3 |
| Title of publication | New Axially Chiral Biaryl Quinoline Ligands Specifically with AgOTf Enabled an Enantioselective Aza-Friedel Crafts Reaction |
| Authors of publication | Gao, Su-Fan; Fu, Xiao; Zhang, Qian-Mao; Tang, Ren-Zhi; Wan, Wenjuan; Wang, Li-Xin |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 10.54932 ± 0.00014 Å |
| b | 10.64007 ± 0.00018 Å |
| c | 21.4433 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2406.91 ± 0.06 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.046 |
| Residual factor for significantly intense reflections | 0.0432 |
| Weighted residual factors for significantly intense reflections | 0.1173 |
| Weighted residual factors for all reflections included in the refinement | 0.1209 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
| 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 |
|---|---|---|---|
| 298550 (current) | 2025-03-21 | cif/ Adding structures of 7160435 via cif-deposit CGI script. |
7160435.cif |
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Users of the data should acknowledge the original authors of the
structural data.