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Information card for entry 7132557
Preview
Coordinates | 7132557.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C2.15 H3.08 B1.54 |
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Calculated formula | C2.15385 H3.07692 B1.53846 |
Title of publication | Iridium-catalyzed selective arylation of B(6)-H of 3-aryl-<i>o</i>-carboranes with arylboronic acid <i>via</i> direct B-H activation. |
Authors of publication | Yang, Han-Bo; Guo, Yan; Cao, Ke; Jiang, Qi-Jia; Teng, Chao-Chao; Zhu, Dao-Yong; Wang, Shao-Hua |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2024 |
Journal volume | 60 |
Journal issue | 9 |
Pages of publication | 1124 - 1127 |
a | 15.8355 ± 0.0012 Å |
b | 10.979 ± 0.0009 Å |
c | 9.9081 ± 0.0007 Å |
α | 90° |
β | 100.451 ± 0.002° |
γ | 90° |
Cell volume | 1694 ± 0.2 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 K |
Number of distinct elements | 3 |
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 | 0.1311 |
Residual factor for significantly intense reflections | 0.0673 |
Weighted residual factors for significantly intense reflections | 0.141 |
Weighted residual factors for all reflections included in the refinement | 0.1764 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
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/7132557.html
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