Information card for entry 4512215

Structure parameters

• Formula: C38 H31 N5 O5 Zn
• Calculated formula: C38 H31 N5 O5 Zn
• Title of publication: Tuning Two-Dimensional Layer to Three-Dimensional Pillar-Layered Metal‒Organic Frameworks: Polycatenation and Interpenetration Behaviors
• Authors of publication: Chen, Di-ming; Zhang, Xiao-ping; Shi, Wei; Cheng, Peng
• Journal of publication: Crystal Growth & Design
• Year of publication: 2014
• Journal volume: 14
• Journal issue: 12
• Pages of publication: 6261
• a: 11.4424 ± 0.0005 Å
• b: 15.1352 ± 0.0008 Å
• c: 15.2141 ± 0.0009 Å
• α: 112.002 ± 0.005°
• β: 96.433 ± 0.004°
• γ: 98.574 ± 0.004°
• Cell volume: 2374.8 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0751
• Residual factor for significantly intense reflections: 0.0585
• Weighted residual factors for significantly intense reflections: 0.1466
• Weighted residual factors for all reflections included in the refinement: 0.1568
• Goodness-of-fit parameter for all reflections included in the refinement: 0.974
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No