Information card for entry 4504050

Structure parameters

• Formula: C112 H70 Cd4 N16 O19
• Calculated formula: C112 H64 Cd4 N16 O19
• Title of publication: Three Novel Cd(II) Metal−Organic Frameworks Constructed from Mixed Ligands of Dipyrido[3,2-d:2‘,3‘-f]quinoxaline and Benzene-dicarboxylate: From a 1-D Ribbon, 2-D Layered Network, to a 3-D Architecture
• Authors of publication: Wang, Xiu-Li; Bi, Yan-Feng; Lin, Hong-Yan; Liu, Guo-Cheng
• Journal of publication: Crystal Growth & Design
• Year of publication: 2007
• Journal volume: 7
• Journal issue: 6
• Pages of publication: 1086
• a: 14.8793 ± 0.0019 Å
• b: 13.3752 ± 0.0017 Å
• c: 24.586 ± 0.003 Å
• α: 90°
• β: 99.691 ± 0.002°
• γ: 90°
• Cell volume: 4823.1 ± 1 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0928
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.0724
• Weighted residual factors for all reflections included in the refinement: 0.0874
• Goodness-of-fit parameter for all reflections included in the refinement: 0.987
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No