Information card for entry 7203665

Structure parameters

• Formula: C35 H22 Br2 Cl2 N2
• Calculated formula: C35 H24 Br2 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: 18.522 ± 0.006 Å
• b: 8.282 ± 0.001 Å
• c: 19.622 ± 0.006 Å
• α: 90°
• β: 100.02 ± 0.01°
• γ: 90°
• Cell volume: 2964.1 ± 1.4 ų
• Cell temperature: 294 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for all reflections included in the refinement: 0.056
• Goodness-of-fit parameter for all reflections included in the refinement: 1.65
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No