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Information card for entry 4518783
Preview
Coordinates | 4518783.cif |
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Original paper (by DOI) | HTML |
Formula | C34 H28 N6 O9 Zn |
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Calculated formula | C34 H28 N6 O9 Zn |
Title of publication | Combining <i>In Situ</i> Techniques (XRD, IR, and <sup>13</sup>C NMR) and Gas Adsorption Measurements Reveals CO<sub>2</sub>-Induced Structural Transitions and High CO<sub>2</sub>/CH<sub>4</sub> Selectivity for a Flexible Metal-Organic Framework JUK-8. |
Authors of publication | Roztocki, Kornel; Rauche, Marcus; Bon, Volodymyr; Kaskel, Stefan; Brunner, Eike; Matoga, Dariusz |
Journal of publication | ACS applied materials & interfaces |
Year of publication | 2021 |
Journal volume | 13 |
Journal issue | 24 |
Pages of publication | 28503 - 28513 |
a | 13.8699 ± 0.0003 Å |
b | 17.5411 ± 0.0003 Å |
c | 27.7173 ± 0.0003 Å |
α | 90° |
β | 94.007 ± 0.001° |
γ | 90° |
Cell volume | 6726.9 ± 0.2 Å3 |
Cell temperature | 130 ± 2 K |
Ambient diffraction temperature | 130 ± 1 K |
Number of distinct elements | 5 |
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 | 0.1066 |
Residual factor for significantly intense reflections | 0.0594 |
Weighted residual factors for significantly intense reflections | 0.1118 |
Weighted residual factors for all reflections included in the refinement | 0.1278 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.085 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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