Information card for entry 4134054
Formula |
C48 H30 Mg1.92 N6 O13 V1.08 |
Calculated formula |
C48 H30 Mg1.893 N6 O13 V1.107 |
Title of publication |
Pore-Space-Partition-Enabled Exceptional Ethane Uptake and Ethane-Selective Ethane‒Ethylene Separation |
Authors of publication |
Yang, Huajun; Wang, Yanxiang; Krishna, Rajamani; Jia, Xiaoxia; Wang, Yong; Hong, Anh N.; Dang, Candy; Castillo, Henry E.; Bu, Xianhui; Feng, Pingyun |
Journal of publication |
Journal of the American Chemical Society |
Year of publication |
2020 |
a |
16.79 ± 0.04 Å |
b |
16.79 ± 0.04 Å |
c |
14.84 ± 0.04 Å |
α |
90° |
β |
90° |
γ |
120° |
Cell volume |
3623 ± 16 Å3 |
Cell temperature |
296 ± 2 K |
Ambient diffraction temperature |
296 ± 2 K |
Number of distinct elements |
6 |
Space group number |
194 |
Hermann-Mauguin space group symbol |
P 63/m m c |
Hall space group symbol |
-P 6c 2c |
Residual factor for all reflections |
0.0991 |
Residual factor for significantly intense reflections |
0.0675 |
Weighted residual factors for significantly intense reflections |
0.1759 |
Weighted residual factors for all reflections included in the refinement |
0.1904 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.187 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
Yes |
Has Fobs |
No |
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https://www.crystallography.net/4134054.html