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Information card for entry 4035297
Preview
| Coordinates | 4035297.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C34 H12 B2 F18 O S4 |
|---|---|
| Calculated formula | C34 H12 B2 F18 O S4 |
| Title of publication | An Air-Stable Organoboron Compound, Dithienooxadiborepine: Preparation and Functionalization. |
| Authors of publication | Yan, Qifan; Yin, Mengxuan; Chen, Cheng; Zhang, Yuankun |
| Journal of publication | The Journal of organic chemistry |
| Year of publication | 2018 |
| Journal volume | 83 |
| Journal issue | 16 |
| Pages of publication | 9096 - 9102 |
| a | 15.4128 ± 0.0008 Å |
| b | 15.3848 ± 0.0008 Å |
| c | 16.322 ± 0.0008 Å |
| α | 90° |
| β | 111.557 ± 0.002° |
| γ | 90° |
| Cell volume | 3599.6 ± 0.3 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0482 |
| Residual factor for significantly intense reflections | 0.0408 |
| Weighted residual factors for significantly intense reflections | 0.0998 |
| Weighted residual factors for all reflections included in the refinement | 0.1059 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 226761 (current) | 2019-11-11 | cif/ Adding structures of 4035297 via cif-deposit CGI script. |
4035297.cif |
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Users of the data should acknowledge the original authors of the
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