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Information card for entry 7130253
Preview
Coordinates | 7130253.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C33 H57 F3 O3 |
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Calculated formula | C33 H57 F3 O3 |
Title of publication | Janus faced fluorocyclohexanes for supramolecular assembly: Synthesis and solid state structures of equatorial mono-, di- and tri alkylated cyclohexanes and with tri-axial C-F bonds to impart polarity. |
Authors of publication | Poskin, Thomas J.; Piscelli, Bruno A.; Yoshida, Keigo; Cordes, David Bradford; Slawin, Alexandra; Cormanich, Rodrigo A.; Yamada, Shigeyuki; O'Hagan, David |
Journal of publication | Chemical Communications |
Year of publication | 2022 |
a | 19.1482 ± 0.0008 Å |
b | 4.711 ± 0.0002 Å |
c | 19.567 ± 0.0009 Å |
α | 90° |
β | 117.937 ± 0.006° |
γ | 90° |
Cell volume | 1559.39 ± 0.15 Å3 |
Cell temperature | 173 K |
Ambient diffraction temperature | 173 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0808 |
Residual factor for significantly intense reflections | 0.0786 |
Weighted residual factors for significantly intense reflections | 0.1986 |
Weighted residual factors for all reflections included in the refinement | 0.2025 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7130253.html
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