Information card for entry 7216560

Structure parameters

• Formula: C22 H12 Br2 Cl2 N2
• Calculated formula: C22 H12 Br2 Cl2 N2
• Title of publication: Interlocking molecular grid lattices involving weak assembly forces
• Authors of publication: Alshahateet, Solhe F.; Rahman, A. Noman M. M.; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.
• Journal of publication: CrystEngComm
• Year of publication: 2002
• Journal volume: 4
• Journal issue: 97
• Pages of publication: 585
• a: 12.866 ± 0.004 Å
• b: 13.845 ± 0.004 Å
• c: 12.361 ± 0.004 Å
• α: 90°
• β: 114.8 ± 0.01°
• γ: 90°
• Cell volume: 1998.8 ± 1.1 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: 0.039
• Weighted residual factors for all reflections included in the refinement: 0.047
• Goodness-of-fit parameter for all reflections included in the refinement: 1.47
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No