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