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Information card for entry 4349918
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Coordinates | 4349918.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C22 H12 Cu2 O10 S2 |
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Calculated formula | C22 H12 Cu2 O10 S2 |
Title of publication | Two NbO-type MOFs based on linear and zigzag diisophthalate ligands: exploring the effect of ligand-originated MOF isomerization on gas adsorption properties |
Authors of publication | Wang, Yao; He, Minghui; Gao, Xiaoxia; Zhang, Yingying; Zhong, Haoyan; Long, Piao; Wang, Xia; He, Yabing |
Journal of publication | Inorganic Chemistry Frontiers |
Year of publication | 2018 |
Journal volume | 5 |
Journal issue | 11 |
Pages of publication | 2811 |
a | 18.4854 ± 0.0003 Å |
b | 18.4854 ± 0.0003 Å |
c | 44.3369 ± 0.001 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 13120.6 ± 0.4 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 166 |
Hermann-Mauguin space group symbol | R -3 m :H |
Hall space group symbol | -R 3 2" |
Residual factor for all reflections | 0.0737 |
Residual factor for significantly intense reflections | 0.0698 |
Weighted residual factors for significantly intense reflections | 0.2844 |
Weighted residual factors for all reflections included in the refinement | 0.2959 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.393 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4349918.html
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