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Information card for entry 1572161
Preview
| Coordinates | 1572161.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H31 Cl Cu N |
|---|---|
| Calculated formula | C21 H31 Cl Cu N |
| Title of publication | Streamlined synthetic assembly of α-chiral CAAC ligands and catalytic performance of their copper and ruthenium complexes. |
| Authors of publication | Madron du Vigné, Adrien; Cramer, Nicolai |
| Journal of publication | Chemical science |
| Year of publication | 2024 |
| Journal volume | 15 |
| Journal issue | 34 |
| Pages of publication | 13864 - 13871 |
| a | 8.14215 ± 0.00012 Å |
| b | 11.39563 ± 0.0002 Å |
| c | 21.7386 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2017.01 ± 0.05 Å3 |
| Cell temperature | 140 ± 0.1 K |
| Ambient diffraction temperature | 140 ± 0.1 K |
| Number of distinct elements | 5 |
| 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 | 0.0211 |
| Residual factor for significantly intense reflections | 0.0202 |
| Weighted residual factors for significantly intense reflections | 0.0538 |
| Weighted residual factors for all reflections included in the refinement | 0.0544 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
| 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 |
|---|---|---|---|
| 294501 (current) | 2024-09-06 | cif/ Updating files of 1572161, 1572162, 1572163, 1572164, 1572165, 1572166 Original log message: Adding full bibliography for 1572161--1572166.cif. |
1572161.cif |
| 293532 | 2024-07-25 | cif/ Adding structures of 1572161, 1572162, 1572163, 1572164, 1572165, 1572166 via cif-deposit CGI script. |
1572161.cif |
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Users of the data should acknowledge the original authors of the
structural data.