Information card for entry 7104315

Structure parameters

• Formula: C124 H136 F24 N10 O20 P4
• Calculated formula: C124 H136 F24 N10 O20 P4
• Title of publication: A pentiptycene-based bis(crown ether) host: synthesis and its complexation with cyclobis(paraquat-p-phenylene).
• Authors of publication: Cao, Jing; Jiang, Yi; Zhao, Jian-Min; Chen, Chuan-Feng
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 15
• Pages of publication: 1987 - 1989
• a: 16.438 ± 0.003 Å
• b: 17.451 ± 0.004 Å
• c: 24.315 ± 0.005 Å
• α: 94.03 ± 0.03°
• β: 96.82 ± 0.03°
• γ: 116.28 ± 0.03°
• Cell volume: 6151 ± 2 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 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: 0.1294
• Residual factor for significantly intense reflections: 0.0636
• Weighted residual factors for significantly intense reflections: 0.1419
• Weighted residual factors for all reflections included in the refinement: 0.1717
• Goodness-of-fit parameter for all reflections included in the refinement: 0.971
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No