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Information card for entry 7123760
Preview
| Coordinates | 7123760.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C29 H49 N5 O Zn |
|---|---|
| Calculated formula | C29 H49 N5 O Zn |
| Title of publication | Synthesis of an Enantiopure Scorpionate Ligand by a Nucleophilic Addition to a Ketenimine and a Zinc Initiator for the Isoselective ROP of rac-Lactide |
| Authors of publication | Honrado, Manuel; Sobrino Ramírez, Sonia; Juan, Fernandez-Baeza; SÁNCHEZ-BARBA MERLO, LUIS FERNANDO; Garcés Osado, Andrés; Lara, Agustin; Rodríguez, Ana María |
| Journal of publication | Chemical Communications |
| Year of publication | 2019 |
| a | 7.9364 ± 0.0009 Å |
| b | 21.825 ± 0.002 Å |
| c | 17.4095 ± 0.0017 Å |
| α | 90° |
| β | 93.64 ± 0.006° |
| γ | 90° |
| Cell volume | 3009.4 ± 0.5 Å3 |
| Cell temperature | 110 ± 2 K |
| Ambient diffraction temperature | 110 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.138 |
| Residual factor for significantly intense reflections | 0.0612 |
| Weighted residual factors for significantly intense reflections | 0.1387 |
| Weighted residual factors for all reflections included in the refinement | 0.1849 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.862 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 216680 (current) | 2019-07-03 | cif/ Adding structures of 7123760 via cif-deposit CGI script. |
7123760.cif |
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Users of the data should acknowledge the original authors of the
structural data.