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Information card for entry 1555115
Preview
| Coordinates | 1555115.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C33 H29 Cl N2 O3 |
|---|---|
| Calculated formula | C33 H29 Cl N2 O3 |
| Title of publication | Efficient construction of pyrrolo[1′,2′:1,2]azocino[4,5-c]quinolines via cascade cycloaddition and annulation reaction |
| Authors of publication | Wu, Wen-Tao; Han, Ying; Sun, Jing; Yan, Chao-Guo |
| Journal of publication | Organic Chemistry Frontiers |
| Year of publication | 2019 |
| Journal volume | 6 |
| Journal issue | 20 |
| Pages of publication | 3530 |
| a | 17.7343 ± 0.0017 Å |
| b | 13.4538 ± 0.0011 Å |
| c | 24.68 ± 0.002 Å |
| α | 90° |
| β | 94.67 ± 0.003° |
| γ | 90° |
| Cell volume | 5868.9 ± 0.9 Å3 |
| Cell temperature | 273 ± 2 K |
| Ambient diffraction temperature | 273 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.1516 |
| Residual factor for significantly intense reflections | 0.0662 |
| Weighted residual factors for significantly intense reflections | 0.1679 |
| Weighted residual factors for all reflections included in the refinement | 0.2067 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.016 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 238330 (current) | 2019-11-24 | cif/ Adding structures of 1555115, 1555116, 1555117, 1555118 via cif-deposit CGI script. |
1555115.cif |
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Users of the data should acknowledge the original authors of the
structural data.