Information card for entry 7203663

Structure parameters

• Formula: C37 H22 Br2 Cl10 N2
• Calculated formula: C37 H22 Br2 Cl10 N2
• Title of publication: Inclusion of polyhalomethanes by a tetrahalogenated diquinoline host
• Authors of publication: Ashmore, Jason; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.
• Journal of publication: CrystEngComm
• Year of publication: 2006
• Journal volume: 8
• Journal issue: 12
• Pages of publication: 923
• a: 16.888 ± 0.005 Å
• b: 12.43 ± 0.006 Å
• c: 19.756 ± 0.006 Å
• α: 90°
• β: 96.98 ± 0.02°
• γ: 90°
• Cell volume: 4116 ± 3 ų
• Cell temperature: 294 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.071
• Weighted residual factors for all reflections included in the refinement: 0.091
• Goodness-of-fit parameter for all reflections included in the refinement: 1.93
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No