Information card for entry 7209688

Structure parameters

• Formula: C66 H106 N2 O36 P S4 Y
• Calculated formula: C66 H106 N2 O36 P S4 Y
• Title of publication: Micelle to extended multi-component bilayer systems involving decyl and dodecyl imidazolium and pyridinium cations
• Authors of publication: Ling, Irene; Sobolev, Alexandre N.; Alias, Yatimah; Raston, Colin L.
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 15
• Pages of publication: 2888
• a: 14.1484 ± 0.0005 Å
• b: 14.2777 ± 0.0005 Å
• c: 21.0378 ± 0.0007 Å
• α: 106.575 ± 0.003°
• β: 95.223 ± 0.003°
• γ: 100.968 ± 0.003°
• Cell volume: 3950.8 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2079
• Residual factor for significantly intense reflections: 0.1557
• Weighted residual factors for significantly intense reflections: 0.3324
• Weighted residual factors for all reflections included in the refinement: 0.3666
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No