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CIF Information Card
Information card for 7151822
7151821 << 7151822 >> 7151823Preview
|
Coordinates |
7151822.cif |
Structure parameters
| Formula | - C28 H29 N O3 - |
| Calculated formula | - C28 H29 N O3 - |
| Title of publication | Cascade reaction of β,γ-unsaturated α-ketoesters with phenols in trityl chloride/TFA system. Highly selective synthesis of 4-aryl-2H-chromenes and their applications. |
| Authors of publication | Wu, Yan-Chao; Li, Hui-Jing; Liu, Li; Liu, Zhe; Wang, Dong; Chen, Yong-Jun |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2011 |
| Journal volume | 9 |
| Journal issue | 8 |
| Pages of publication | 2868 - 2877 |
| a | 6.0368 ± 0.0012 Å |
| b | 13.398 ± 0.003 Å |
| c | 29.789 ± 0.006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2409.4 ± 0.9 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | P 21 21 21 |
| Hall symmetry space group | P 2ac 2ab |
| Residual factor for all reflections | 0.0698 |
| Residual factor for observed reflections | 0.0436 |
| Weighted residual factors for the observed reflections | 0.1095 |
| Weighted residual factors for all reflections included in the refinement | 0.1307 |
| Goodness-of-fit parameter for observed reflections | 1.01 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |