Information card for entry 1563750
| Formula |
C25 H29 N O3 |
| Calculated formula |
C25 H29 N O3 |
| Title of publication |
Assembly of Multicyclic Isoquinoline Scaffolds from Pyridines: Formal Total Synthesis of Fredericamycin A |
| Authors of publication |
Wang, Fang-Xin; Yan, Jialei; Liu, Zhixin; Zhu, Tingshun; Liu, Yingguo; Ren, Shichao; Lv, Wen-Xin; Jin, Zhichao; Chi, Yonggui Robin |
| Journal of publication |
Chemical Science |
| Year of publication |
2021 |
| a |
6.5078 ± 0.0007 Å |
| b |
6.7349 ± 0.0007 Å |
| c |
25.061 ± 0.003 Å |
| α |
88.115 ± 0.006° |
| β |
87.858 ± 0.006° |
| γ |
68.927 ± 0.005° |
| Cell volume |
1024 ± 0.2 Å3 |
| Cell temperature |
100 ± 2 K |
| Ambient diffraction temperature |
100 ± 2 K |
| Number of distinct elements |
4 |
| Space group number |
1 |
| Hermann-Mauguin space group symbol |
P 1 |
| Hall space group symbol |
P 1 |
| Residual factor for all reflections |
0.0998 |
| Residual factor for significantly intense reflections |
0.092 |
| Weighted residual factors for significantly intense reflections |
0.2722 |
| Weighted residual factors for all reflections included in the refinement |
0.2824 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.073 |
| Diffraction radiation wavelength |
1.54178 Å |
| Diffraction radiation type |
CuKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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https://www.crystallography.net/1563750.html