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Information card for entry 1547197
Preview
Coordinates | 1547197.cif |
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Original paper (by DOI) | HTML |
Formula | C22 H22 N2 O6 |
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Calculated formula | C22 H22 N2 O6 |
SMILES | c1cccc2c1c(=O)c1c([nH]2)[nH]c(c1c1ccccc1)C(=O)OCCO.C(CO)O |
Title of publication | Tandem Synthesis of Pyrrolo[2,3-b]quinolones via Cadogen-Type Reaction. |
Authors of publication | Lin, Zhichen; Hu, Zhongyan; Zhang, Xin; Dong, Jinhuan; Liu, Jian-Biao; Chen, De-Zhan; Xu, Xianxiu |
Journal of publication | Organic letters |
Year of publication | 2017 |
Journal volume | 19 |
Journal issue | 19 |
Pages of publication | 5284 - 5287 |
a | 6.105 ± 0.0012 Å |
b | 17.278 ± 0.003 Å |
c | 9.698 ± 0.002 Å |
α | 90° |
β | 97.095 ± 0.004° |
γ | 90° |
Cell volume | 1015.1 ± 0.3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0838 |
Residual factor for significantly intense reflections | 0.0494 |
Weighted residual factors for significantly intense reflections | 0.1054 |
Weighted residual factors for all reflections included in the refinement | 0.1317 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
Diffraction radiation wavelength | 0.71069 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/1547197.html
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