Information card for entry 4105936

Structure parameters

• Formula: C36 Br6 N12 O Zn3
• Calculated formula: C36 Br6 N12 Zn3
• Title of publication: Dramatic Structural Rearrangements in Porous Coordination Networks
• Authors of publication: Javier Martí-Rujas; Nazrul Islam; Daisuke Hashizume; Fujio Izumi; Makoto Fujita; Masaki Kawano
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 5853 - 5860
• a: 23.089 ± 0.002 Å
• b: 22.702 ± 0.002 Å
• c: 15.646 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8201.1 ± 1.1 ų
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for significantly intense reflections: 0.0399
• Weighted residual factors for significantly intense reflections: 0.0539
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 1.3 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No