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CIF Information Card
Information card for 7151732
7151731 << 7151732 >> 7151733Preview
|
Coordinates |
7151732.cif |
Structure parameters
| Common name | Compound-24A |
| Formula | - C34 H30 N2 O - |
| Calculated formula | - C34 H30 N2 O - |
| Title of publication | Intramolecular Diels-Alder chemistry of 4-vinylimidazoles. |
| Authors of publication | He, Yong; Krishnamoorthy, Pasupathy; Lima, Heather M.; Chen, Yingzhong; Wu, Haiyan; Sivappa, Rasapalli; Dias, H. V. Rasika; Lovely, Carl J. |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2011 |
| Journal volume | 9 |
| Journal issue | 8 |
| Pages of publication | 2685 - 2701 |
| a | 9.4283 ± 0.0016 Å |
| b | 10.252 ± 0.002 Å |
| c | 14.872 ± 0.004 Å |
| α | 77.695 ± 0.017° |
| β | 79.25 ± 0.017° |
| γ | 71.711 ± 0.014° |
| Cell volume | 1322.4 ± 0.5 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Residual factor for all reflections | 0.0826 |
| Residual factor for observed reflections | 0.0517 |
| Weighted residual factors for the observed reflections | 0.1156 |
| Weighted residual factors for all reflections included in the refinement | 0.1313 |
| Goodness-of-fit parameter for observed reflections | 1.01 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |