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Information card for entry 4132870
Preview
Coordinates | 4132870.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C51.97 H68.53 F2.13 N9 O11.54 S3 |
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Calculated formula | C52.02 H68.56 F2.16 N9 O11.54 S3 |
Title of publication | Guest Exchange through Facilitated Transport in a Seemingly Impenetrable Hydrogen-Bonded Framework. |
Authors of publication | Li, Yuantao; Handke, Marcel; Chen, Yu-Sheng; Shtukenberg, Alexander G.; Hu, Chunhua T.; Ward, Michael D. |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2018 |
Journal volume | 140 |
Journal issue | 40 |
Pages of publication | 12915 - 12921 |
a | 23.56 ± 0.02 Å |
b | 7.427 ± 0.007 Å |
c | 24.06 ± 0.02 Å |
α | 90° |
β | 119.054 ± 0.008° |
γ | 90° |
Cell volume | 3680 ± 6 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.186 |
Residual factor for significantly intense reflections | 0.1634 |
Weighted residual factors for significantly intense reflections | 0.4232 |
Weighted residual factors for all reflections included in the refinement | 0.4395 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.669 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/4132870.html
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