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CIF Information Card
Information card for 7151730
7151729 << 7151730 >> 7151731Preview
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Coordinates |
7151730.cif |
Structure parameters
| Common name | 1,2-syn-2,3-anti-iodoalcohol |
| Chemical name | (1S,2S,3S)-1-(2',2',2'-trichloromethylcarbonylamino)-2-hydroxy-3-iodocyclohexane |
| Formula | - C8 H11 Cl3 I N O2 - |
| Calculated formula | - C8 H11 Cl3 I N O2 - |
| Title of publication | Stereoselective synthesis of polyhydroxylated aminocyclohexanes. |
| Authors of publication | Ahmad, Sajjad; Thomas, Lynne H.; Sutherland, Andrew |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2011 |
| Journal volume | 9 |
| Journal issue | 8 |
| Pages of publication | 2801 - 2808 |
| a | 8.0678 ± 0.0001 Å |
| b | 16.6957 ± 0.0002 Å |
| c | 9.6537 ± 0.0001 Å |
| α | 90° |
| β | 99.437 ± 0.001° |
| γ | 90° |
| Cell volume | 1282.73 ± 0.03 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Hermann-Mauguin symmetry space group | P 1 21 1 |
| Hall symmetry space group | P 2yb |
| Residual factor for all reflections | 0.0449 |
| Residual factor for observed reflections | 0.0313 |
| Weighted residual factors for all reflections included in the refinement | 0.0585 |
| Goodness-of-fit parameter for observed reflections | 0.977 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |