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Information card for entry 7242970
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Coordinates | 7242970.cif |
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Original paper (by DOI) | HTML |
Formula | C32 H23 N O6 S |
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Calculated formula | C32 H23 N O6 S |
Title of publication | Construction of cyclopentane-fused coumarins via DBU-catalyzed [3+2] cycloaddition of 3-homoacyl coumarins with cyclic 1-azadienes |
Authors of publication | Lin, Huawei; Yang, Huimin; Gong, Qi; Luo, Shan; Gu, Jing; Cao, Xiaoqun; Mao, Biming; Ge, Yanqing; Yuan, Chunhao |
Journal of publication | RSC Advances |
Year of publication | 2021 |
Journal volume | 11 |
Journal issue | 33 |
Pages of publication | 20118 - 20122 |
a | 10.5537 ± 0.001 Å |
b | 11.0474 ± 0.0011 Å |
c | 13.2402 ± 0.0013 Å |
α | 114.381 ± 0.003° |
β | 99 ± 0.003° |
γ | 101.915 ± 0.003° |
Cell volume | 1324.2 ± 0.2 Å3 |
Cell temperature | 193 ± 2 K |
Ambient diffraction temperature | 193 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0793 |
Residual factor for significantly intense reflections | 0.0758 |
Weighted residual factors for significantly intense reflections | 0.2104 |
Weighted residual factors for all reflections included in the refinement | 0.2158 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
Diffraction radiation wavelength | 1.34139 Å |
Diffraction radiation type | GaKα |
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/7242970.html
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Users of the data should acknowledge the original authors of the
structural data.