Information card for entry 4505787

Structure parameters

• Formula: C49 H31 Br8 N4
• Calculated formula: C49 H31 Br8 N4
• Title of publication: Staircase Inclusion Compounds Formed by Tetrahalodiquinoline Hosts
• Authors of publication: Rahman, A. Noman M. M.; Bishop, Roger; Craig, Donald C.; Marjo, Christopher E.; Scudder, Marcia L.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2002
• Journal volume: 2
• Journal issue: 5
• Pages of publication: 421
• a: 13.29 ± 0.005 Å
• b: 13.753 ± 0.006 Å
• c: 14.598 ± 0.006 Å
• α: 80.53 ± 0.03°
• β: 66.83 ± 0.03°
• γ: 65.85 ± 0.03°
• Cell volume: 2238.3 ± 1.7 ų
• Cell temperature: 294 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 significantly intense reflections: 0.055
• Weighted residual factors for all reflections included in the refinement: 0.078
• Goodness-of-fit parameter for all reflections included in the refinement: 1.44
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No