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Information card for entry 1558878
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Coordinates | 1558878.cif |
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Original paper (by DOI) | HTML |
Formula | C36 H34 N4 O14 Zn2 |
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Calculated formula | C36 H34 N4 O14 Zn2 |
Title of publication | Inclusion of viologen cations leads to switchable metal-organic frameworks. |
Authors of publication | Cadman, Laura K.; Mahon, Mary F.; Burrows, Andrew D. |
Journal of publication | Faraday discussions |
Year of publication | 2021 |
Journal volume | 225 |
Pages of publication | 414 - 430 |
a | 9.6981 ± 0.0002 Å |
b | 16.1078 ± 0.0005 Å |
c | 11.5458 ± 0.0004 Å |
α | 90° |
β | 90.923 ± 0.003° |
γ | 90° |
Cell volume | 1803.39 ± 0.09 Å3 |
Cell temperature | 150.01 ± 0.1 K |
Ambient diffraction temperature | 150.01 ± 0.1 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0559 |
Residual factor for significantly intense reflections | 0.043 |
Weighted residual factors for significantly intense reflections | 0.1085 |
Weighted residual factors for all reflections included in the refinement | 0.1157 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
261709 (current) | 2021-02-05 | cif/ Updating files of 1558875, 1558876, 1558877, 1558878 Original log message: Adding full bibliography for 1558875--1558878.cif. |
1558878.cif |
255472 | 2020-08-20 | cif/ Adding structures of 1558875, 1558876, 1558877, 1558878 via cif-deposit CGI script. |
1558878.cif |
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Users of the data should acknowledge the original authors of the
structural data.