Information card for entry 1577115
| Formula |
C28 H25 N O2 |
| Calculated formula |
C28 H25 N O2 |
| Title of publication |
Electrochemically Driven Strain-Release Dearomative (3+2) Cyclization for the Synthesis of Bicyclo[2.1.1]hexane-Fused Polycyclic Spiroindolines |
| Authors of publication |
Zhu, Yanren; Pu, Enfan; Yang, Shaoxiong; Zhao, Dongbo; Xu, Qi; Jiang, Piaopiao; Li, Xiong; Zhang, Hongbin; Chen, Jingbo |
| Journal of publication |
Chemical Science |
| Year of publication |
2026 |
| a |
9.6936 ± 0.0004 Å |
| b |
14.0626 ± 0.0005 Å |
| c |
16.2 ± 0.0006 Å |
| α |
86.652 ± 0.002° |
| β |
82.679 ± 0.001° |
| γ |
77.887 ± 0.001° |
| Cell volume |
2140.43 ± 0.14 Å3 |
| Cell temperature |
100 K |
| Ambient diffraction temperature |
100 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 |
0.0839 |
| Residual factor for significantly intense reflections |
0.0591 |
| Weighted residual factors for significantly intense reflections |
0.1229 |
| Weighted residual factors for all reflections included in the refinement |
0.1391 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.059 |
| Diffraction radiation probe |
x-ray |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/1577115.html
