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Information card for entry 4518559
Preview
Coordinates | 4518559.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C50 H31 Li2 N2 O12 Zn2 |
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Calculated formula | C50 H29 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 | 18.9053 ± 0.0003 Å |
b | 17.21449 ± 0.00018 Å |
c | 18.3643 ± 0.0003 Å |
α | 90° |
β | 119.705 ± 0.002° |
γ | 90° |
Cell volume | 5191.18 ± 0.17 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 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 | 0.0449 |
Residual factor for significantly intense reflections | 0.0417 |
Weighted residual factors for significantly intense reflections | 0.1382 |
Weighted residual factors for all reflections included in the refinement | 0.1403 |
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 | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4518559.html
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