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Information card for entry 2010583
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| Coordinates | 2010583.cif |
|---|---|
| Structure factors | 2010583.hkl |
| Original IUCr paper | HTML |
| Formula | C20 H28 O4 |
|---|---|
| Calculated formula | C20 H28 O4 |
| SMILES | O(C(=O)[C@@]12OC(=O)[C@@](C)(CC1)C2(C)C)C[C@@H]([C@H]1C=CC(=C)CC1)C |
| Title of publication | (1<i>R</i>,2<i>R</i>)-2-(4-Methylenecyclohex-2-enyl)propyl (1<i>R</i>,4<i>S</i>)-camphanate |
| Authors of publication | Körner, Ferdinand; Schürmann, Markus; Preut, Hans; Kreiser, Wolfgang |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2000 |
| Journal volume | 56 |
| Journal issue | 1 |
| Pages of publication | 76 - 77 |
| a | 6.2171 ± 0.0006 Å |
| b | 12.5197 ± 0.0009 Å |
| c | 12.2224 ± 0.0009 Å |
| α | 90° |
| β | 97.225 ± 0.005° |
| γ | 90° |
| Cell volume | 943.79 ± 0.13 Å3 |
| Cell temperature | 291 ± 1 K |
| Ambient diffraction temperature | 291 ± 1 K |
| Number of distinct elements | 3 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0477 |
| Residual factor for significantly intense reflections | 0.0336 |
| Weighted residual factors for all reflections included in the refinement | 0.086 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.997 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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Users of the data should acknowledge the original authors of the
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