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Information card for entry 1565319
Preview
Coordinates | 1565319.cif |
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Original paper (by DOI) | HTML |
Formula | C42 H22 F12 N2 |
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Calculated formula | C42 H22 F12 N2 |
Title of publication | Programmable photoresponsive materials based on a single molecule via distinct topochemical reactions |
Authors of publication | Wei, Xiao; Li, Bao; Yang, Zhiqiang; Zhong, RongLin; Wang, Yufei; Chen, yanan; Ding, Zeyang; Men, Guangwen; Yang, Zairan; Zhang, Houyu; Yang, Bing; Xu, Weiqing; Jiang, Shimei |
Journal of publication | Chemical Science |
Year of publication | 2021 |
a | 16.3007 ± 0.0012 Å |
b | 18.4842 ± 0.0013 Å |
c | 12.5889 ± 0.0009 Å |
α | 90° |
β | 109.832 ± 0.003° |
γ | 90° |
Cell volume | 3568.1 ± 0.4 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
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 | 0.078 |
Residual factor for significantly intense reflections | 0.0438 |
Weighted residual factors for significantly intense reflections | 0.1016 |
Weighted residual factors for all reflections included in the refinement | 0.1265 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
270749 (current) | 2021-11-19 | cif/ Adding structures of 1565319, 1565320, 1565321, 1565322 via cif-deposit CGI script. |
1565319.cif |
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Users of the data should acknowledge the original authors of the
structural data.