Information card for entry 7151603

Structure parameters

• Common name: 2,2'-dihydroxyl-1,1'-binaphthyl 6-methylquinoline clathrate
• Chemical name: 2,2'-dihydroxyl-1,1'-binaphthyl 6-methylquinoline clathrate
• Formula: C45 H36.5 N2.5 O2
• Calculated formula: C45 H32 N2.5 O2
• Title of publication: Inclusion of quinolines by binaphthol: structures and selectivity.
• Authors of publication: Caira, Mino R.; Paul Chang, Y.; Nassimbeni, Luigi R.; Su, Hong
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2004
• Journal volume: 2
• Journal issue: 5
• Pages of publication: 655 - 659
• a: 8.8396 ± 0.0001 Å
• b: 9.4695 ± 0.0001 Å
• c: 21.6106 ± 0.0003 Å
• α: 94.652 ± 0.001°
• β: 98.068 ± 0.001°
• γ: 103.822 ± 0.001°
• Cell volume: 1726.77 ± 0.04 ų
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.118
• Residual factor for significantly intense reflections: 0.0745
• Weighted residual factors for significantly intense reflections: 0.2028
• Weighted residual factors for all reflections included in the refinement: 0.2283
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No