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Information card for entry 1573238
Preview
| Coordinates | 1573238.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C15 H29 Li N2 |
|---|---|
| Calculated formula | C15 H29 Li N2 |
| Title of publication | Unlocking Regioselectivity: Steric Effects and Conformational Constraints of Lewis Bases in Alkyllithium-Initiated Butadiene Polymerization |
| Authors of publication | Tang, Jian; Fu, Yuan; Hua, Jing; Zhang, Jiahao; Peng, Shuoli; Li, Zhibo |
| Journal of publication | Chemical Science |
| Year of publication | 2024 |
| a | 8.9379 ± 0.0003 Å |
| b | 12.3047 ± 0.0004 Å |
| c | 14.7566 ± 0.0005 Å |
| α | 89.051 ± 0.003° |
| β | 74.903 ± 0.003° |
| γ | 86.783 ± 0.003° |
| Cell volume | 1564.42 ± 0.09 Å3 |
| Cell temperature | 100 ± 0.1 K |
| Ambient diffraction temperature | 100 ± 0.1 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0896 |
| Residual factor for significantly intense reflections | 0.0728 |
| Weighted residual factors for significantly intense reflections | 0.192 |
| Weighted residual factors for all reflections included in the refinement | 0.2026 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 296023 (current) | 2024-11-21 | cif/ Adding structures of 1573238 via cif-deposit CGI script. |
1573238.cif |
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Users of the data should acknowledge the original authors of the
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