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Information card for entry 7128565
Preview
| Coordinates | 7128565.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C37.5 H33 B Cl F9 N2 O5 |
|---|---|
| Calculated formula | C37.5 H33 B Cl F9 N2 O5 |
| Title of publication | Multi-component synthesis of dihydro-1,3-azaborinine derived oxindole isosteres. |
| Authors of publication | Li, Jun; Daniliuc, Constantin G.; Matern, Jonas; Fernández, Gustavo; Kehr, Gerald; Erker, Gerhard |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2021 |
| Journal volume | 57 |
| Journal issue | 62 |
| Pages of publication | 7689 - 7692 |
| a | 8.7527 ± 0.0002 Å |
| b | 21.114 ± 0.0004 Å |
| c | 21.2756 ± 0.0004 Å |
| α | 105.531 ± 0.001° |
| β | 100.815 ± 0.001° |
| γ | 97.69 ± 0.001° |
| Cell volume | 3649.92 ± 0.13 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0462 |
| Residual factor for significantly intense reflections | 0.0345 |
| Weighted residual factors for significantly intense reflections | 0.0786 |
| Weighted residual factors for all reflections included in the refinement | 0.084 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 268555 (current) | 2021-09-06 | cif/ Updating files of 7128565, 7128566, 7128567 Original log message: Adding full bibliography for 7128565--7128567.cif. |
7128565.cif |
| 266819 | 2021-07-01 | cif/ Adding structures of 7128565, 7128566, 7128567 via cif-deposit CGI script. |
7128565.cif |
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Users of the data should acknowledge the original authors of the
structural data.