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Information card for entry 4517988
Preview
Coordinates | 4517988.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C13 H13 N O |
---|---|
Calculated formula | C13 H13 N O |
Title of publication | Photocatalytic Intramolecular [2 + 2] Cycloaddition of Indole Derivatives via Energy Transfer: A Method for Late-Stage Skeletal Transformation |
Authors of publication | Zhang, Zhijie; Yi, Dong; Zhang, Min; Wei, Jun; Lu, Ji; Yang, Lin; Wang, Jun; Hao, Na; Pan, Xianchao; Zhang, Shiqi; Wei, Siping; Fu, Qiang |
Journal of publication | ACS Catalysis |
Year of publication | 2020 |
Pages of publication | 10149 - 10156 |
a | 8.31074 ± 0.00018 Å |
b | 13.9007 ± 0.0003 Å |
c | 8.8665 ± 0.0002 Å |
α | 90° |
β | 96.992 ± 0.002° |
γ | 90° |
Cell volume | 1016.69 ± 0.04 Å3 |
Cell temperature | 289.9 ± 0.8 K |
Ambient diffraction temperature | 289.9 ± 0.8 K |
Number of distinct elements | 4 |
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 | 0.0584 |
Residual factor for significantly intense reflections | 0.055 |
Weighted residual factors for significantly intense reflections | 0.1432 |
Weighted residual factors for all reflections included in the refinement | 0.1487 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.037 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4517988.html
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Users of the data should acknowledge the original authors of the
structural data.