Information card for entry 7203664

Structure parameters

• Formula: C36 H23 Br5 Cl2 N2
• Calculated formula: C36 H23 Br5 Cl2 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: 20.081 ± 0.006 Å
• b: 14.094 ± 0.004 Å
• c: 12.065 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3414.7 ± 1.6 ų
• Cell temperature: 294 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for significantly intense reflections: 0.064
• Weighted residual factors for all reflections included in the refinement: 0.065
• Goodness-of-fit parameter for all reflections included in the refinement: 1.72
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No