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Information card for entry 7239722
Preview
Coordinates | 7239722.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C26 H22 O4 |
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Calculated formula | C26 H22 O4 |
Title of publication | Diels‒Alder reactions between cyclopentadiene analogs and benzoquinone in water and their application in the synthesis of polycyclic cage compounds |
Authors of publication | Shi, Yijun; Liu, Xuejing; Han, Ying; Yan, Peng; Bie, Fusheng; Cao, Han |
Journal of publication | RSC Advances |
Year of publication | 2020 |
Journal volume | 10 |
Journal issue | 2 |
Pages of publication | 739 - 745 |
a | 9.2415 ± 0.0004 Å |
b | 11.3298 ± 0.0005 Å |
c | 8.8293 ± 0.0004 Å |
α | 90° |
β | 90.639 ± 0.004° |
γ | 90° |
Cell volume | 924.41 ± 0.07 Å3 |
Cell temperature | 199.98 ± 0.1 K |
Ambient diffraction temperature | 199.98 ± 0.1 K |
Number of distinct elements | 3 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0577 |
Residual factor for significantly intense reflections | 0.0455 |
Weighted residual factors for significantly intense reflections | 0.1076 |
Weighted residual factors for all reflections included in the refinement | 0.1152 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
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/7239722.html
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Users of the data should acknowledge the original authors of the
structural data.