Information card for entry 4510407

Structure parameters

• Formula: C56 H50 N4 O14 Zn2
• Calculated formula: C56 H50 N4 O14 Zn2
• Title of publication: A Microporous Metal‒Organic Framework Constructed from a New Tetracarboxylic Acid for Selective Gas Separation
• Authors of publication: Alawisi, Hussah; Li, Bin; He, Yabing; Arman, Hadi D.; Asiri, Abdullah M.; Wang, Hailong; Chen, Banglin
• Journal of publication: Crystal Growth & Design
• Year of publication: 2014
• Journal volume: 14
• Journal issue: 5
• Pages of publication: 2522
• a: 17.053 ± 0.006 Å
• b: 11.363 ± 0.004 Å
• c: 18.518 ± 0.006 Å
• α: 90°
• β: 116.226 ± 0.004°
• γ: 90°
• Cell volume: 3218.9 ± 1.9 ų
• Cell temperature: 98 ± 2 K
• Ambient diffraction temperature: 98 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.1139
• Residual factor for significantly intense reflections: 0.1088
• Weighted residual factors for significantly intense reflections: 0.3484
• Weighted residual factors for all reflections included in the refinement: 0.3606
• Goodness-of-fit parameter for all reflections included in the refinement: 1.65
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No