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Information card for entry 7156509
Preview
Coordinates | 7156509.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C18 H16 N2 O |
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Calculated formula | C18 H16 N2 O |
Title of publication | Regioselective [3 + 2]-annulation of hydrazonyl chlorides with 1,3-dicarbonyl compounds for assembling of polysubstituted pyrazoles. |
Authors of publication | Liu, Kun; Shang, Xinye; Cheng, Yuyu; Chang, Xiaoyong; Li, Pengfei; Li, Wenjun |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2018 |
Journal volume | 16 |
Journal issue | 42 |
Pages of publication | 7811 - 7814 |
a | 14.2864 ± 0.0013 Å |
b | 5.3688 ± 0.0005 Å |
c | 19.4632 ± 0.0016 Å |
α | 90° |
β | 108.952 ± 0.003° |
γ | 90° |
Cell volume | 1411.9 ± 0.2 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0526 |
Residual factor for significantly intense reflections | 0.0422 |
Weighted residual factors for significantly intense reflections | 0.1004 |
Weighted residual factors for all reflections included in the refinement | 0.1067 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
Diffraction radiation probe | x-ray |
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/7156509.html
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