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Information card for entry 7158624
Preview
Coordinates | 7158624.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C13 H17 B N5 O0.5 |
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Calculated formula | C13 H17 B N5 O0.5 |
Title of publication | Radical borylation of vinyl azides with NHC-boranes: divergent synthesis of α-boryl ketones and borylated triazoles. |
Authors of publication | Zhang, Yifei; Liao, Yangzhen; Liu, Peijun; Ran, Yu; Liu, Xiaozu |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2022 |
Journal volume | 20 |
Journal issue | 17 |
Pages of publication | 3550 - 3557 |
a | 13.1462 ± 0.0013 Å |
b | 8.7576 ± 0.0007 Å |
c | 25.691 ± 0.002 Å |
α | 90° |
β | 102.499 ± 0.009° |
γ | 90° |
Cell volume | 2887.7 ± 0.4 Å3 |
Cell temperature | 100 ± 0.1 K |
Ambient diffraction temperature | 100 ± 0.1 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | I 1 2/a 1 |
Hall space group symbol | -I 2ya |
Residual factor for all reflections | 0.0582 |
Residual factor for significantly intense reflections | 0.0466 |
Weighted residual factors for significantly intense reflections | 0.1073 |
Weighted residual factors for all reflections included in the refinement | 0.1147 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.06 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7158624.html
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Users of the data should acknowledge the original authors of the
structural data.