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Information card for entry 4135553
Preview
Coordinates | 4135553.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C16 H19 N O3 |
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Calculated formula | C16 H19 N O3 |
Title of publication | Enantioselective Inverse Electron Demand (3 + 2) Cycloaddition of Palladium-Oxyallyl Enabled by a Hydrogen-Bond-Donating Ligand. |
Authors of publication | Zheng, Yin; Qin, Tianzhu; Zi, Weiwei |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2021 |
Journal volume | 143 |
Journal issue | 2 |
Pages of publication | 1038 - 1045 |
a | 7.1245 ± 0.0001 Å |
b | 10.7356 ± 0.0001 Å |
c | 19.3304 ± 0.0001 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1478.5 ± 0.03 Å3 |
Cell temperature | 294.15 K |
Ambient diffraction temperature | 294.15 K |
Number of distinct elements | 4 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0312 |
Residual factor for significantly intense reflections | 0.0305 |
Weighted residual factors for significantly intense reflections | 0.0854 |
Weighted residual factors for all reflections included in the refinement | 0.0859 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.049 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
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/4135553.html
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Users of the data should acknowledge the original authors of the
structural data.