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Information card for entry 7247094
Preview
Coordinates | 7247094.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C27 H39 B2 N3 O4 |
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Calculated formula | C27 H39 B2 N3 O4 |
Title of publication | Aqueous hydroboration of alkynes via nonclassical generation of N-heterocyclic carbenes |
Authors of publication | Tao, Sheng; Wang, Yang; Pan, Qianxiu; Zhao, Jixing; Bu, Qingqing; Chen, Fei; Liu, Jichang; Dai, Bin; Wei, Donghui; Liu, Ning |
Journal of publication | Green Chemistry |
Year of publication | 2023 |
Journal volume | 25 |
Journal issue | 17 |
Pages of publication | 6704 - 6716 |
a | 11.5388 ± 0.0005 Å |
b | 15.217 ± 0.0007 Å |
c | 31.3898 ± 0.0014 Å |
α | 88.955 ± 0.002° |
β | 88.529 ± 0.002° |
γ | 76.813 ± 0.003° |
Cell volume | 5364.1 ± 0.4 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 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 | 0.1375 |
Residual factor for significantly intense reflections | 0.0966 |
Weighted residual factors for significantly intense reflections | 0.2478 |
Weighted residual factors for all reflections included in the refinement | 0.2946 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.101 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7247094.html
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structural data.