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Information card for entry 7123556
Preview
| Coordinates | 7123556.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C14 H25 B O4 |
|---|---|
| Calculated formula | C14 H25 B O4 |
| Title of publication | Synthetic studies on the reverse antibiotic natural products, the nybomycins. |
| Authors of publication | Bardell-Cox, Oliver A; White, Andrew J. P.; Aragón, Luis; Fuchter, Matthew J. |
| Journal of publication | MedChemComm |
| Year of publication | 2019 |
| Journal volume | 10 |
| Journal issue | 8 |
| Pages of publication | 1438 - 1444 |
| a | 8.9148 ± 0.0005 Å |
| b | 9.6905 ± 0.0008 Å |
| c | 18.8528 ± 0.0013 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1628.7 ± 0.2 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0646 |
| Residual factor for significantly intense reflections | 0.0496 |
| Weighted residual factors for significantly intense reflections | 0.1048 |
| Weighted residual factors for all reflections included in the refinement | 0.1161 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.063 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301860 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/12/ Each referenced PubChem compound corresponds to the full crystal structure. |
7123556.cif |
| 224642 | 2019-11-08 | cif/ Updating files of 7123556 Original log message: Adding full bibliography for 7123556.cif. |
7123556.cif |
| 215519 | 2019-05-25 | cif/ Adding structures of 7123556 via cif-deposit CGI script. |
7123556.cif |
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Users of the data should acknowledge the original authors of the
structural data.