Information card for entry 7050850

Structure parameters

• Common name: Binaphthol THF
• Chemical name: 2,2'-dihydroxy-1,1'-binaphthyl tetrahydrofuran clathrate
• Formula: C26 H26 O3.5
• Calculated formula: C26 H26 O3.5
• Title of publication: Inclusion compounds of binaphthol with volatile guests: structures, selectivity and kinetics of desolvation
• Authors of publication: Nassimbeni, Luigi R.; Su, Hong
• Journal of publication: New Journal of Chemistry
• Year of publication: 2002
• Journal volume: 26
• Journal issue: 8
• Pages of publication: 989
• a: 14.651 ± 0.002 Å
• b: 55.471 ± 0.006 Å
• c: 10.259 ± 0.001 Å
• α: 90 ± 0.003°
• β: 90 ± 0.003°
• γ: 90 ± 0.003°
• Cell volume: 8337.5 ± 1.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 3
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.1052
• Residual factor for significantly intense reflections: 0.0993
• Weighted residual factors for significantly intense reflections: 0.2664
• Weighted residual factors for all reflections included in the refinement: 0.2748
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No