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Information card for entry 7131690
Preview
Coordinates | 7131690.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C19 H20 Cl N O |
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Calculated formula | C19 H20 Cl N O |
Title of publication | Highly regioselective and stereoselective cascade reductive cyclization of δ-ketoamide: practical access to oxa-bridged benzazepines. |
Authors of publication | Ye, Hao; Zhu, Xi-Wei; Pan, Yi-Yun; Sun, Jie; Sun, Fei; Wu, Xin-Xing |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2023 |
Journal volume | 59 |
Journal issue | 49 |
Pages of publication | 7587 - 7590 |
a | 7.564 ± 0.009 Å |
b | 10.371 ± 0.012 Å |
c | 11.366 ± 0.014 Å |
α | 109.224 ± 0.014° |
β | 91.783 ± 0.015° |
γ | 96.951 ± 0.014° |
Cell volume | 833.3 ± 1.7 Å3 |
Cell temperature | 273 ± 2 K |
Ambient diffraction temperature | 273 ± 2 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 | 0.2439 |
Residual factor for significantly intense reflections | 0.1879 |
Weighted residual factors for significantly intense reflections | 0.2712 |
Weighted residual factors for all reflections included in the refinement | 0.2955 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.355 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
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/7131690.html
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structural data.