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Information card for entry 7042853
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Coordinates | 7042853.cif |
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Original paper (by DOI) | HTML |
Formula | C18 H14 F12 N4 O2 |
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Calculated formula | C18 H14 F12 N4 O2 |
Title of publication | CFA-4 - a fluorinated metal-organic framework with exchangeable interchannel cations |
Authors of publication | Fritzsche, Julia Christina; Grzywa, Maciej; Denysenko, Dmytro; Bon, Volodymyr; Senkovska, Irena; Kaskel, Stefan; Volkmer, Dirk |
Journal of publication | Dalton Trans. |
Year of publication | 2017 |
a | 8.899 ± 0.0005 Å |
b | 14.7907 ± 0.0007 Å |
c | 8.9987 ± 0.0008 Å |
α | 90° |
β | 111.494 ± 0.002° |
γ | 90° |
Cell volume | 1102.06 ± 0.13 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 12 |
Hermann-Mauguin space group symbol | C 1 2/m 1 |
Hall space group symbol | -C 2y |
Residual factor for all reflections | 0.0388 |
Residual factor for significantly intense reflections | 0.0286 |
Weighted residual factors for significantly intense reflections | 0.0662 |
Weighted residual factors for all reflections included in the refinement | 0.072 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.945 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
195901 (current) | 2017-05-03 | cif/ Adding structures of 7042853, 7042854 via cif-deposit CGI script. |
7042853.cif |
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Users of the data should acknowledge the original authors of the
structural data.