Information card for entry 7702946

Structure parameters

• Common name: Zinc (imdazolate, benzimidazolate, 5-methyl-benzimidazolate) solid solution
• Chemical name: ZIF-UC-1g
• Formula: C18.78 H21.46 N8.65 O0.65 Zn2
• Calculated formula: C19.078 H12.791 N8.647 O0.647 Zn2
• Title of publication: Relating structural disorder and melting in complex mixed ligand zeolitic imidazolate framework glasses.
• Authors of publication: Ríos Gómez, María Laura; Lampronti, Giulio Isacco; Yang, Yongjian; Mauro, John C.; Bennett, Thomas Douglas
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 3
• Pages of publication: 850 - 857
• a: 15.6574 ± 0.0005 Å
• b: 15.9532 ± 0.0005 Å
• c: 18.5634 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4636.9 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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 all reflections: 0.0845
• Residual factor for significantly intense reflections: 0.0785
• Weighted residual factors for significantly intense reflections: 0.2299
• Weighted residual factors for all reflections included in the refinement: 0.2349
• Goodness-of-fit parameter for all reflections included in the refinement: 1.175
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No