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Information card for entry 4125262
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Coordinates | 4125262.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C58 H92 F N5 O2 |
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Calculated formula | C58 H92 F N5 O2 |
Title of publication | Hydrogen-Bonded Homoleptic Fluoride-Diarylurea Complexes: Structure, Reactivity, and Coordinating Power. |
Authors of publication | Pfeifer, Lukas; Engle, Keary M.; Pidgeon, George W.; Sparkes, Hazel A.; Thompson, Amber L.; Brown, John M.; Gouverneur, Véronique |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2016 |
Journal volume | 138 |
Journal issue | 40 |
Pages of publication | 13314 |
a | 12.8854 ± 0.0001 Å |
b | 16.5136 ± 0.0001 Å |
c | 26.1896 ± 0.0002 Å |
α | 90° |
β | 98.5587 ± 0.0007° |
γ | 90° |
Cell volume | 5510.68 ± 0.07 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 K |
Number of distinct elements | 5 |
Space group number | 7 |
Hermann-Mauguin space group symbol | P 1 n 1 |
Hall space group symbol | P -2yac |
Residual factor for all reflections | 0.0586 |
Residual factor for significantly intense reflections | 0.0558 |
Weighted residual factors for all reflections | 0.1691 |
Weighted residual factors for significantly intense reflections | 0.1654 |
Weighted residual factors for all reflections included in the refinement | 0.1689 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.9959 |
Diffraction radiation wavelength | 1.5419 Å |
Diffraction radiation type | CuKα |
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/4125262.html
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