Information card for entry 2017767

Structure parameters

• Chemical name: 4-methoxyanilinium tetrafluoroborate–2,5,8,15,18,21- hexaoxatricyclo[20.4.0.0^9,14^]hexacosa-1(26),9,11,13,22,24-hexaene (1/1)
• Formula: C27 H34 B F4 N O7
• Calculated formula: C27 H34 B F4 N O7
• Title of publication: 4-Methoxyanilinium tetrafluoroborate–dibenzo-18-crown-6 (1/1)
• Authors of publication: Fu, Xue-qun; Yang, Yong-le; Ye, Qiong
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 8
• Pages of publication: o433 - o435
• a: 8.863 ± 0.004 Å
• b: 16.408 ± 0.007 Å
• c: 18.806 ± 0.008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2735 ± 2 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0565
• Residual factor for significantly intense reflections: 0.0502
• Weighted residual factors for significantly intense reflections: 0.1025
• Weighted residual factors for all reflections included in the refinement: 0.105
• Goodness-of-fit parameter for all reflections included in the refinement: 1.155
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes