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Information card for entry 1502320
Preview
Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 1502320.cif |
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Original paper (by DOI) | HTML |
Formula | C20 H12 Cl N O2 |
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Calculated formula | C20 H12 Cl N O2 |
Title of publication | CuCl2-promoted 6-endo-dig chlorocyclization and oxidative aromatization cascade: efficient construction of 1-azaanthraquinones from N-propargylaminoquinones. |
Authors of publication | Fei, Na; Yin, Hao; Wang, Shaozhong; Wang, Huaqin; Yao, Zhu-Jun |
Journal of publication | Organic letters |
Year of publication | 2011 |
Journal volume | 13 |
Journal issue | 16 |
Pages of publication | 4208 - 4211 |
a | 8.265 ± 0.0017 Å |
b | 6.753 ± 0.0014 Å |
c | 14.254 ± 0.003 Å |
α | 90° |
β | 103.68 ± 0.03° |
γ | 90° |
Cell volume | 773 ± 0.3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 11 |
Hermann-Mauguin space group symbol | P 1 21/m 1 |
Hall space group symbol | -P 2yb |
Residual factor for all reflections | 0.0777 |
Residual factor for significantly intense reflections | 0.0533 |
Weighted residual factors for significantly intense reflections | 0.1362 |
Weighted residual factors for all reflections included in the refinement | 0.1538 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.003 |
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/1502320.html
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Users of the data should acknowledge the original authors of the
structural data.