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Information card for entry 2200000
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| Coordinates | 2200000.cif |
|---|---|
| Structure factors | 2200000.hkl |
| Original IUCr paper | HTML |
| Common name | ricciocarpin A |
|---|---|
| Formula | C15 H20 O3 |
| Calculated formula | C15 H20 O3 |
| SMILES | c1c([C@H]2OC(=O)[C@H]3CCCC([C@@H]3C2)(C)C)cco1 |
| Title of publication | Ricciocarpin A |
| Authors of publication | Wang, Yanmei; Tan, Geok-Kheng; Koh, Lip-Lin; Harrison, Leslie J. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2005 |
| Journal volume | 61 |
| Journal issue | 11 |
| Pages of publication | o3800 - o3801 |
| a | 8.506 ± 0.0007 Å |
| b | 7.4661 ± 0.0007 Å |
| c | 10.733 ± 0.001 Å |
| α | 90° |
| β | 102.626 ± 0.002° |
| γ | 90° |
| Cell volume | 665.13 ± 0.1 Å3 |
| Cell temperature | 295 ± 2 K |
| Ambient diffraction temperature | 295 ± 2 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 | 0.0654 |
| Residual factor for significantly intense reflections | 0.0613 |
| Weighted residual factors for significantly intense reflections | 0.1441 |
| Weighted residual factors for all reflections included in the refinement | 0.1462 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.192 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
Version history
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Users of the data should acknowledge the original authors of the
structural data.