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Information card for entry 7231606
Preview
| Coordinates | 7231606.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C44 H34 N2 O4 |
|---|---|
| Calculated formula | C44 H34 N2 O4 |
| Title of publication | Transition metal/Brønsted acid cooperative catalysis enabled facile synthesis of 8-hydroxyquinolines through one-pot reactions of ortho-aminophenol, aldehydes and alkynes |
| Authors of publication | Yu, Shuyan; Wu, Jingxin; Lan, Hongbing; Xu, Hanwen; Shi, Xiaofei; Zhu, Xuewen; Yin, Zhigang |
| Journal of publication | RSC Advances |
| Year of publication | 2018 |
| Journal volume | 8 |
| Journal issue | 59 |
| Pages of publication | 33968 |
| a | 10.0073 ± 0.0004 Å |
| b | 12.1668 ± 0.0005 Å |
| c | 15.4066 ± 0.0005 Å |
| α | 67.8 ± 0.003° |
| β | 87.298 ± 0.003° |
| γ | 81.654 ± 0.004° |
| Cell volume | 1718.35 ± 0.12 Å3 |
| Cell temperature | 293 K |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0488 |
| Residual factor for significantly intense reflections | 0.0405 |
| Weighted residual factors for significantly intense reflections | 0.11 |
| Weighted residual factors for all reflections included in the refinement | 0.119 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301866 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure. |
7231606.cif |
| 211318 | 2018-10-04 | cif/ Adding structures of 7231606, 7231607 via cif-deposit CGI script. |
7231606.cif |
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Users of the data should acknowledge the original authors of the
structural data.