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Information card for entry 7230952
Preview
Coordinates | 7230952.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C42 H22 Cu2 O10 |
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Calculated formula | C42 H22 Cu2 O10 |
Title of publication | Two interpenetrated metal‒organic frameworks with a slim ethynyl-based ligand: designed for selective gas adsorption and structural tuning |
Authors of publication | Kong, Xiang-Jing; Zhang, Yong-Zheng; He, Tao; Wu, Xue-Qian; Xu, Ming-Ming; Wang, Si-Nan; Xie, Lin-Hua; Li, Jian-Rong |
Journal of publication | CrystEngComm |
Year of publication | 2018 |
Journal volume | 20 |
Journal issue | 39 |
Pages of publication | 6018 |
a | 42.7196 ± 0.0015 Å |
b | 23.6272 ± 0.0018 Å |
c | 21.5936 ± 0.0009 Å |
α | 90° |
β | 120.317 ± 0.004° |
γ | 90° |
Cell volume | 18814.8 ± 1.9 Å3 |
Cell temperature | 100.01 ± 0.1 K |
Ambient diffraction temperature | 100.01 ± 0.1 K |
Number of distinct elements | 4 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.1478 |
Residual factor for significantly intense reflections | 0.0991 |
Weighted residual factors for significantly intense reflections | 0.2629 |
Weighted residual factors for all reflections included in the refinement | 0.2937 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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