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Information card for entry 1557890
Preview
| Coordinates | 1557890.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H23 Cl O6 |
|---|---|
| Calculated formula | C20 H23 Cl O6 |
| Title of publication | Resorcylic Acid Lactones from an Ilyonectria sp. |
| Authors of publication | Zhou, Jia; Gao, Ying; Chang, Jin-Ling; Yu, Heng-Yi; Chen, Juan; Zhou, Ming; Meng, Xiang-Gao; Ruan, Han-Li |
| Journal of publication | Journal of Natural Products |
| Year of publication | 2020 |
| a | 36.0878 ± 0.0007 Å |
| b | 10.8258 ± 0.0001 Å |
| c | 26.8601 ± 0.0009 Å |
| α | 90° |
| β | 131.699 ± 0.003° |
| γ | 90° |
| Cell volume | 7835.1 ± 0.5 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 5 |
| Hermann-Mauguin space group symbol | C 1 2 1 |
| Hall space group symbol | C 2y |
| Residual factor for all reflections | 0.0567 |
| Residual factor for significantly intense reflections | 0.0482 |
| Weighted residual factors for significantly intense reflections | 0.138 |
| Weighted residual factors for all reflections included in the refinement | 0.1452 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 251105 (current) | 2020-04-23 | cif/ Adding structures of 1557890 via cif-deposit CGI script. |
1557890.cif |
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Users of the data should acknowledge the original authors of the
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