Information card for entry 1567984
Formula |
C22 H24 |
Calculated formula |
C22 H24 |
Title of publication |
InI3-catalyzed polyene cyclization of allenes and its application in the total synthesis of seven abietane-type diterpenoids |
Authors of publication |
Huo, Chen-Yu; Zheng, Tian-Lu; Dai, Wei-Hao; Zhang, Zi-Hao; Wang, Jin-Da; Zhu, Dao-Yong; Wang, Shao-Hua; Zhang, Xiao-Ming; Xu, Xue-Tao |
Journal of publication |
Chemical Science |
Year of publication |
2022 |
a |
17.4778 ± 0.0004 Å |
b |
17.4778 ± 0.0004 Å |
c |
9.964 ± 0.0002 Å |
α |
90° |
β |
90° |
γ |
120° |
Cell volume |
2635.95 ± 0.1 Å3 |
Cell temperature |
149.99 ± 0.1 K |
Ambient diffraction temperature |
149.99 ± 0.1 K |
Number of distinct elements |
2 |
Space group number |
169 |
Hermann-Mauguin space group symbol |
P 61 |
Hall space group symbol |
P 61 |
Residual factor for all reflections |
0.0446 |
Residual factor for significantly intense reflections |
0.0408 |
Weighted residual factors for significantly intense reflections |
0.1093 |
Weighted residual factors for all reflections included in the refinement |
0.1125 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.083 |
Diffraction radiation probe |
x-ray |
Diffraction radiation wavelength |
1.54184 Å |
Diffraction radiation type |
CuKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
No |
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https://www.crystallography.net/1567984.html