Information card for entry 7052865

Structure parameters

• Formula: C64 H98 Cs2 F12 O17 P2
• Calculated formula: C64 H96 Cs2 F12 O17 P2
• Title of publication: Cation binding resorcinarene bis-crowns: the effect of lower rim alkyl chain length on crystal packing and solid lipid nanoparticles
• Authors of publication: Helttunen, Kaisa; Salorinne, Kirsi; Barboza, Tahnie; Barbosa, Hélène Campos; Suhonen, Aku; Nissinen, Maija
• Journal of publication: New Journal of Chemistry
• Year of publication: 2012
• Journal volume: 36
• Journal issue: 3
• Pages of publication: 789
• a: 12.5169 ± 0.0003 Å
• b: 17.8145 ± 0.0005 Å
• c: 18.0005 ± 0.0005 Å
• α: 70.468 ± 0.0019°
• β: 79.987 ± 0.0016°
• γ: 82.768 ± 0.0014°
• Cell volume: 3715.26 ± 0.18 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0482
• Residual factor for significantly intense reflections: 0.0449
• Weighted residual factors for significantly intense reflections: 0.1125
• Weighted residual factors for all reflections included in the refinement: 0.1152
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No