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Information card for entry 7242064
Preview
Coordinates | 7242064.cif |
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Original paper (by DOI) | HTML |
Formula | C24 H27 Br3 N6 |
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Calculated formula | C24 H27 Br3 N6 |
Title of publication | Boosting activity of molecular oxygen by pyridinium-based photocatalysts for metal-free alcohol oxidation |
Authors of publication | Ma, Shuai; Cui, Jing-Wang; Rao, Cai-Hui; Jia, Meng-Ze; Chen, Yun-Rui; Zhang, Jie |
Journal of publication | Green Chemistry |
Year of publication | 2021 |
Journal volume | 23 |
Journal issue | 3 |
Pages of publication | 1337 - 1343 |
a | 16.647 ± 0.003 Å |
b | 16.647 ± 0.003 Å |
c | 7.749 ± 0.003 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 1859.7 ± 0.9 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
Space group number | 160 |
Hermann-Mauguin space group symbol | R 3 m :H |
Hall space group symbol | R 3 -2" |
Residual factor for all reflections | 0.0752 |
Residual factor for significantly intense reflections | 0.0518 |
Weighted residual factors for significantly intense reflections | 0.147 |
Weighted residual factors for all reflections included in the refinement | 0.2245 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.886 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
262669 (current) | 2021-03-05 | cif/ Updating files of 7242064 Original log message: Adding full bibliography for 7242064.cif. |
7242064.cif |
260942 | 2021-01-14 | cif/ Adding structures of 7242064 via cif-deposit CGI script. |
7242064.cif |
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structural data.