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Information card for entry 7202286
Preview
Coordinates | 7202286.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C76 H86 Cl2 N4 O8 |
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Calculated formula | C76 H86 Cl2 N4 O8 |
Title of publication | The role of cation⋯π interactions in capsule formation: co-crystals of resorcinarenes and alkyl ammonium salts |
Authors of publication | Busi, Sara; Saxell, Heidi; Fröhlich, Roland; Rissanen, Kari |
Journal of publication | CrystEngComm |
Year of publication | 2008 |
Journal volume | 10 |
Journal issue | 12 |
Pages of publication | 1803 |
a | 12.851 ± 0.003 Å |
b | 14.534 ± 0.003 Å |
c | 20.177 ± 0.004 Å |
α | 106.64 ± 0.03° |
β | 98.21 ± 0.03° |
γ | 99.87 ± 0.03° |
Cell volume | 3483.1 ± 1.6 Å3 |
Cell temperature | 173 ± 0.1 K |
Ambient diffraction temperature | 173 ± 0.1 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.186 |
Residual factor for significantly intense reflections | 0.1145 |
Weighted residual factors for significantly intense reflections | 0.2292 |
Weighted residual factors for all reflections included in the refinement | 0.2668 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.119 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
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/7202286.html
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