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Information card for entry 4089449
Preview
| Coordinates | 4089449.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H23 N3 O Zn |
|---|---|
| Calculated formula | C18 H23 N3 O Zn |
| SMILES | [Zn]12(OC(=CC(=[N]1c1ccccc1n1[n]2c(cc1C)C)C)C)CC |
| Title of publication | Rapid and Controlled Polymerization of rac-Lactide Using N,N,O-Chelate Zinc Enolate Catalysts |
| Authors of publication | Yu, Xiao-Feng; Zhang, Cheng; Wang, Zhong-Xia |
| Journal of publication | Organometallics |
| Year of publication | 2013 |
| Journal volume | 32 |
| Journal issue | 11 |
| Pages of publication | 3262 |
| a | 7.8795 ± 0.0011 Å |
| b | 15.154 ± 0.002 Å |
| c | 15.398 ± 0.002 Å |
| α | 90° |
| β | 99.754 ± 0.002° |
| γ | 90° |
| Cell volume | 1812 ± 0.4 Å3 |
| Cell temperature | 294 ± 2 K |
| Ambient diffraction temperature | 294 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0828 |
| Residual factor for significantly intense reflections | 0.0643 |
| Weighted residual factors for significantly intense reflections | 0.1741 |
| Weighted residual factors for all reflections included in the refinement | 0.1904 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.085 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 243646 (current) | 2019-11-26 | cif/ Adding structures of 4089449, 4089450 via cif-deposit CGI script. |
4089449.cif |
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Users of the data should acknowledge the original authors of the
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