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Information card for entry 4135386
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Coordinates | 4135386.cif |
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Original paper (by DOI) | HTML |
Formula | C17 H19 N O3 |
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Calculated formula | C17 H19 N O3 |
Title of publication | Discovery of Oxygen α-Nucleophilic Addition to α,β-Unsaturated Amides Catalyzed by Redox-Neutral Organic Photoreductant. |
Authors of publication | Luan, Zi-Hong; Qu, Jian-Ping; Kang, Yan-Biao |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2020 |
Journal volume | 142 |
Journal issue | 50 |
Pages of publication | 20942 - 20947 |
a | 8.70779 ± 0.00014 Å |
b | 9.8648 ± 0.0002 Å |
c | 18.3289 ± 0.0003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1574.46 ± 0.05 Å3 |
Cell temperature | 291 ± 2 K |
Ambient diffraction temperature | 291 ± 2 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 | 0.0363 |
Residual factor for significantly intense reflections | 0.0351 |
Weighted residual factors for significantly intense reflections | 0.0951 |
Weighted residual factors for all reflections included in the refinement | 0.0966 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.055 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
260430 (current) | 2021-01-04 | cif/ Updating files of 4135385, 4135386, 4135387, 4135388 Original log message: Adding full bibliography for 4135385--4135388.cif. |
4135386.cif |
259473 | 2020-12-03 | cif/ Adding structures of 4135386 via cif-deposit CGI script. |
4135386.cif |
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