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Information card for entry 1542431
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Coordinates | 1542431.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | [9-BBN(i-DCDM)][HBCF] |
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Formula | C33 H27 B2 F15 N2 |
Calculated formula | C33 H27.0001 B2 F15 N2 |
Title of publication | Highly selective catalytic trans-hydroboration of alkynes mediated by borenium cations and B(C6F5)3 |
Authors of publication | McGough, John S.; Butler, Samuel M.; Cade, Ian A.; Ingleson, Michael J. |
Journal of publication | Chem. Sci. |
Year of publication | 2016 |
Journal volume | 7 |
Journal issue | 5 |
Pages of publication | 3384 |
a | 10.3052 ± 0.001 Å |
b | 33.5364 ± 0.0019 Å |
c | 10.5825 ± 0.0011 Å |
α | 90° |
β | 117.953 ± 0.013° |
γ | 90° |
Cell volume | 3230.6 ± 0.6 Å3 |
Cell temperature | 151 ± 2 K |
Ambient diffraction temperature | 151 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0985 |
Residual factor for significantly intense reflections | 0.0717 |
Weighted residual factors for all reflections | 0.1613 |
Weighted residual factors for significantly intense reflections | 0.1491 |
Weighted residual factors for all reflections included in the refinement | 0.1613 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.0269 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/1542431.html
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