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Information card for entry 7129837
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Coordinates | 7129837.cif |
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Original paper (by DOI) | HTML |
Formula | C29 H28 F N O4 |
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Calculated formula | C29 H28 F N O4 |
Title of publication | Transition-metal-free approaches to 2,3-diarylated indenones from 2-alkynylbenzaldehydes and phenols with tunable selectivity. |
Authors of publication | Yao, Tuanli; Zhao, Shuaijing; Liu, Tao; Wu, Yuting; Ma, Yanhui; Li, Tao; Qin, Xiangyang |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2022 |
Journal volume | 58 |
Journal issue | 29 |
Pages of publication | 4592 - 4595 |
a | 9.4344 ± 0.0004 Å |
b | 10.4959 ± 0.0005 Å |
c | 14.3304 ± 0.0006 Å |
α | 96.736 ± 0.002° |
β | 104.101 ± 0.002° |
γ | 94.205 ± 0.002° |
Cell volume | 1359.1 ± 0.1 Å3 |
Cell temperature | 301 ± 2 K |
Ambient diffraction temperature | 301 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 | 0.0851 |
Residual factor for significantly intense reflections | 0.0573 |
Weighted residual factors for significantly intense reflections | 0.1697 |
Weighted residual factors for all reflections included in the refinement | 0.1845 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
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/7129837.html
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Users of the data should acknowledge the original authors of the
structural data.