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Information card for entry 7239878
Preview
| Coordinates | 7239878.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C20 H15 Cl O5 |
|---|---|
| Calculated formula | C20 H15 Cl O5 |
| Title of publication | Total synthesis of Palmarumycin BGs, C1 and Guignardin E |
| Authors of publication | Liu, Xinlei; Li, Shuyi; Wei, Xinyu; Zhao, Yu; Lai, Daowan; Zhou, Ligang; Wang, Mingan |
| Journal of publication | RSC Advances |
| Year of publication | 2020 |
| Journal volume | 10 |
| Journal issue | 3 |
| Pages of publication | 1588 - 1594 |
| a | 8.7889 ± 0.0003 Å |
| b | 10.1048 ± 0.0005 Å |
| c | 8.8667 ± 0.0003 Å |
| α | 90° |
| β | 93.111 ± 0.003° |
| γ | 90° |
| Cell volume | 786.29 ± 0.05 Å3 |
| Cell temperature | 114 ± 4 K |
| Ambient diffraction temperature | 114 ± 4 K |
| Number of distinct elements | 4 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0394 |
| Residual factor for significantly intense reflections | 0.0379 |
| Weighted residual factors for significantly intense reflections | 0.0975 |
| Weighted residual factors for all reflections included in the refinement | 0.099 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.042 |
| 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 |
|---|---|---|---|
| 301866 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure. |
7239878.cif |
| 258147 | 2020-10-06 | cif/ Updating files of 7239878 Original log message: Adding full bibliography for 7239878.cif. |
7239878.cif |
| 247562 | 2020-02-04 | cif/ Adding structures of 7239878 via cif-deposit CGI script. |
7239878.cif |
All data in the COD and the database itself are dedicated to the
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.
Users of the data should acknowledge the original authors of the
structural data.