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Information card for entry 1554568
Preview
| Coordinates | 1554568.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H17 Cl3 O5 |
|---|---|
| Calculated formula | C18 H17 Cl3 O5 |
| Title of publication | Cytorhizophins A and B, benzophenone-hemiterpene adducts from the endophytic fungus Cytospora rhizophorae |
| Authors of publication | Liu, Hongxin; Tan, Haibo; Wang, Wenxuan; Zhang, Wenge; Chen, Yuchan; Li, Saini; Liu, Zhaoming; Li, Haohua; Zhang, Weimin |
| Journal of publication | Organic Chemistry Frontiers |
| Year of publication | 2019 |
| Journal volume | 6 |
| Journal issue | 5 |
| Pages of publication | 591 |
| a | 13.8718 ± 0.0006 Å |
| b | 9.6965 ± 0.0005 Å |
| c | 13.8978 ± 0.0007 Å |
| α | 90° |
| β | 92.204 ± 0.004° |
| γ | 90° |
| Cell volume | 1867.98 ± 0.16 Å3 |
| Cell temperature | 99.9 ± 0.3 K |
| Ambient diffraction temperature | 99.9 ± 0.3 K |
| Number of distinct elements | 4 |
| Space group number | 3 |
| Hermann-Mauguin space group symbol | P 1 2 1 |
| Hall space group symbol | P 2y |
| Residual factor for all reflections | 0.0925 |
| Residual factor for significantly intense reflections | 0.0821 |
| Weighted residual factors for significantly intense reflections | 0.2023 |
| Weighted residual factors for all reflections included in the refinement | 0.2154 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.063 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 237352 (current) | 2019-11-24 | cif/ Adding structures of 1554567, 1554568 via cif-deposit CGI script. |
1554568.cif |
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Users of the data should acknowledge the original authors of the
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