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Information card for entry 4130231
Preview
| Coordinates | 4130231.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C7 H10 B N O4 |
|---|---|
| Calculated formula | C7 H10 B N O4 |
| Title of publication | Scalable, Metal- and Additive-Free, Photoinduced Borylation of Haloarenes and Quaternary Arylammonium Salts. |
| Authors of publication | Mfuh, Adelphe M.; Doyle, John D.; Chhetri, Bhuwan; Arman, Hadi D.; Larionov, Oleg V. |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2016 |
| Journal volume | 138 |
| Journal issue | 9 |
| Pages of publication | 2985 - 2988 |
| a | 3.7693 ± 0.0004 Å |
| b | 8.5103 ± 0.0011 Å |
| c | 14.0577 ± 0.0017 Å |
| α | 93.315 ± 0.007° |
| β | 91.465 ± 0.006° |
| γ | 94.628 ± 0.007° |
| Cell volume | 448.51 ± 0.09 Å3 |
| Cell temperature | 98 K |
| Ambient diffraction temperature | 98 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0861 |
| Residual factor for significantly intense reflections | 0.0663 |
| Weighted residual factors for significantly intense reflections | 0.1328 |
| Weighted residual factors for all reflections included in the refinement | 0.1436 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.008 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 240742 (current) | 2019-11-25 | cif/ Adding structures of 4130231 via cif-deposit CGI script. |
4130231.cif |
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Users of the data should acknowledge the original authors of the
structural data.