Information card for entry 7208631

Structure parameters

• Formula: C15 H17 N7 O3 Zn
• Calculated formula: C15 H17 N7 O3 Zn
• Title of publication: Guest selectivity of a porous tetrahedral imidazolate framework material during self-assembly
• Authors of publication: Wang, Fei; Yang, Hui; Kang, Yao; Zhang, Jian
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2012
• Journal volume: 22
• Journal issue: 37
• Pages of publication: 19732
• a: 18.6627 ± 0.0005 Å
• b: 10.5533 ± 0.0004 Å
• c: 8.9082 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1754.5 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0655
• Residual factor for significantly intense reflections: 0.0585
• Weighted residual factors for significantly intense reflections: 0.1406
• Weighted residual factors for all reflections included in the refinement: 0.1453
• Goodness-of-fit parameter for all reflections included in the refinement: 1.233
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No