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Information card for entry 4518558
Preview
Coordinates | 4518558.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C54 H36 Li2 N2 O12 Zn2 |
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Calculated formula | C54 H34 Li2 N2 O12 Zn2 |
Title of publication | Metal-Organic Frameworks for Highly Selective Separation of Xylene Isomers and Single-Crystal X-ray Study of Aromatic Guest-Host Inclusion Compounds. |
Authors of publication | Sapianik, Aleksandr A.; Dudko, Evgeny R.; Kovalenko, Konstantin A.; Barsukova, Marina O.; Samsonenko, Denis G.; Dybtsev, Danil N.; Fedin, Vladimir P. |
Journal of publication | ACS applied materials & interfaces |
Year of publication | 2021 |
Journal volume | 13 |
Journal issue | 12 |
Pages of publication | 14768 - 14777 |
a | 19.203 ± 0.004 Å |
b | 16.959 ± 0.002 Å |
c | 18.49 ± 0.003 Å |
α | 90° |
β | 120.276 ± 0.01° |
γ | 90° |
Cell volume | 5200.2 ± 1.6 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
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 | 0.0646 |
Residual factor for significantly intense reflections | 0.0541 |
Weighted residual factors for significantly intense reflections | 0.153 |
Weighted residual factors for all reflections included in the refinement | 0.1596 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.078 |
Diffraction radiation wavelength | 0.79313 Å |
Diffraction radiation type | synchrotron |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4518558.html
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Users of the data should acknowledge the original authors of the
structural data.