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Information card for entry 7245087
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Coordinates | 7245087.cif |
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Original paper (by DOI) | HTML |
Common name | bis-pentafluorbenzamide N-phenylbenzamide |
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Chemical name | '2,3,4,5,6-pentafluoro-N-(perfluorophenyl)benzamide N-phenylbenzamide' |
Formula | C26 H12 F10 N2 O2 |
Calculated formula | C26 H12 F10 N2 O2 |
Title of publication | Effect of Hydrogen Bonds and π...π-interactions on the Crystallization of Phenyl-perfluorophenyl Amides: Understanding the Self-organization of a Cocrystal |
Authors of publication | Pagliari, Anderson; Meyer, Alexandre R.; Solner, Vanessa; Rosa, Jéssica Maria Luis; Hoerner, Manfredo; Gauze Bonacorso, Helio; Zanatta, Nilo; Martins, Marcos A. P. |
Journal of publication | CrystEngComm |
Year of publication | 2022 |
a | 9.58 ± 0.007 Å |
b | 5.8 ± 0.004 Å |
c | 20.624 ± 0.017 Å |
α | 90° |
β | 91.13 ± 0.03° |
γ | 90° |
Cell volume | 1145.7 ± 1.5 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.1262 |
Residual factor for significantly intense reflections | 0.1047 |
Weighted residual factors for significantly intense reflections | 0.223 |
Weighted residual factors for all reflections included in the refinement | 0.2359 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
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/7245087.html
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