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Information card for entry 1569493
Preview
Coordinates | 1569493.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C72 H60 F8 N8 O12 S2 |
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Calculated formula | C72 H60 F8 N8 O12 S2 |
Title of publication | Tetrahomo corona[4]arene-based spirophanes: synthesis, structure, and properties. |
Authors of publication | Guo, Shen-Yi; Zhang, Zhuo-Ang; Tong, Shuo; Guo, Qing-Hui; Hua, Ruimao; Wang, Mei-Xiang |
Journal of publication | Chemical science |
Year of publication | 2023 |
Journal volume | 14 |
Journal issue | 31 |
Pages of publication | 8393 - 8400 |
a | 8.8879 ± 0.0002 Å |
b | 13.4255 ± 0.0005 Å |
c | 14.8388 ± 0.0004 Å |
α | 101.412 ± 0.003° |
β | 103.513 ± 0.002° |
γ | 101.034 ± 0.003° |
Cell volume | 1634.29 ± 0.09 Å3 |
Cell temperature | 172.98 ± 0.17 K |
Ambient diffraction temperature | 172.98 ± 0.17 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1457 |
Residual factor for significantly intense reflections | 0.1171 |
Weighted residual factors for significantly intense reflections | 0.2816 |
Weighted residual factors for all reflections included in the refinement | 0.2904 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.103 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1569493.html
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Users of the data should acknowledge the original authors of the
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