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CIF Information Card
Information card for 7151783
7151782 << 7151783 >> 7151784Preview
|
Coordinates |
7151783.cif |
Structure parameters
| Formula | - C29 H27 N3 O4 - |
| Calculated formula | - C29 H27 N3 O4 - |
| Title of publication | Highly stereoselective double (R)-phenylglycinol-induced cyclocondensation reactions of symmetric aryl bis(oxoacids). |
| Authors of publication | Amat, Mercedes; Arróniz, Carlos; Molins, Elies; Escolano, Carmen; Bosch, Joan |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2011 |
| Journal volume | 9 |
| Journal issue | 7 |
| Pages of publication | 2175 - 2184 |
| a | 10.613 ± 0.004 Å |
| b | 10.186 ± 0.003 Å |
| c | 23.142 ± 0.012 Å |
| α | 90° |
| β | 91.9 ± 0.04° |
| γ | 90° |
| Cell volume | 2500.4 ± 1.8 Å3 |
| Cell temperature | 294 ± 2 K |
| Ambient diffraction temperature | 294 ± 2 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | P 1 21 1 |
| Hall symmetry space group | P 2yb |
| Residual factor for all reflections | 0.0968 |
| Residual factor for observed reflections | 0.0653 |
| Weighted residual factors for the observed reflections | 0.1386 |
| Weighted residual factors for all reflections included in the refinement | 0.158 |
| Goodness-of-fit parameter for observed reflections | 1.119 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |