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CIF Information Card
Information card for 7101813
7101812 << 7101813 >> 7101814Preview
|
Coordinates |
7101813.cif |
Structure parameters
| Formula | - C29 H49 N3 O4 - |
| Calculated formula | - C29 H49 N3 O4 - |
| Title of publication | A new organogelator based on an enantiopure C2 symmetric pyrrolidine. |
| Authors of publication | Cicchi, Stefano; Ghini, Giacomo; Lascialfari, Luisa; Brandi, Alberto; Betti, Francesca; Berti, Debora; Ferrati, Silvia; Baglioni, Piero |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2007 |
| Journal issue | 14 |
| Pages of publication | 1424 - 1426 |
| a | 5.02 ± 0.001 Å |
| b | 16.571 ± 0.001 Å |
| c | 18.4 ± 0.001 Å |
| α | 90° |
| β | 93.37 ± 0.002° |
| γ | 90° |
| Cell volume | 1528 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.0975 |
| Residual factor for observed reflections | 0.0568 |
| Weighted residual factors for the observed reflections | 0.1481 |
| Weighted residual factors for all reflections included in the refinement | 0.1739 |
| Goodness-of-fit parameter for observed reflections | 0.887 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |