Crystallography Open Database
| COD Home |
|---|
| Accessing COD Data |
|---|
| Add Your Data |
|---|
| Documentation |
|---|
CIF Information Card
Information card for 7151781
7151780 << 7151781 >> 7151782Preview
|
Coordinates |
7151781.cif |
Structure parameters
| Formula | - C28 H34 Br2 N4 O6 - |
| Calculated formula | - C11.56 H15.15 Br0.8 N1.66 O2.52 - |
| Title of publication | Synthesis of tri-substituted biaryl based trianglimines: formation of C3-symmetrical and non-symmetrical regioisomers. |
| Authors of publication | Nour, Hany F.; Matei, Marius F.; Bassil, Bassem S.; Kortz, Ulrich; Kuhnert, Nikolai |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2011 |
| Journal volume | 9 |
| Journal issue | 9 |
| Pages of publication | 3258 - 3271 |
| a | 7.8543 ± 0.0006 Å |
| b | 9.3193 ± 0.0007 Å |
| c | 10.5343 ± 0.0006 Å |
| α | 95.589 ± 0.004° |
| β | 110.786 ± 0.002° |
| γ | 95.62 ± 0.004° |
| Cell volume | 710.15 ± 0.09 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Residual factor for all reflections | 0.0318 |
| Residual factor for observed reflections | 0.0274 |
| Weighted residual factors for the observed reflections | 0.0804 |
| Weighted residual factors for all reflections included in the refinement | 0.084 |
| Goodness-of-fit parameter for observed reflections | 1.003 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |