Information card for entry 7104310

Structure parameters

• Formula: C102 H109 N10 O38.5 Zn9
• Calculated formula: C81 H57 N3 O33 Zn9
• Title of publication: A metal-organic framework based on an unprecedented nonanuclear cluster as a secondary building unit: structure and gas sorption behavior.
• Authors of publication: Park, Mira; Moon, Dohyun; Yoon, Ji Woong; Chang, Jong-San; Lah, Myoung Soo
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 15
• Pages of publication: 2026 - 2028
• a: 21.4718 ± 0.0018 Å
• b: 21.4718 ± 0.0018 Å
• c: 22.42 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 8951.7 ± 1.8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 155
• Hermann-Mauguin space group symbol: R 3 2 :H
• Hall space group symbol: R 3 2"
• Residual factor for all reflections: 0.0398
• Residual factor for significantly intense reflections: 0.0339
• Weighted residual factors for significantly intense reflections: 0.0996
• Weighted residual factors for all reflections included in the refinement: 0.1016
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No