Information card for entry 4503564

Structure parameters

• Formula: C43 H39 N4 O19.5 Zn4
• Calculated formula: C43 H39 N4 O19.5 Zn4
• Title of publication: Syntheses, Structures, and Photoluminescence of Four d10Metal−Organic Frameworks Constructed from 3,5-Bis-oxyacetate-benzoic Acid
• Authors of publication: He, Yin-Hua; Feng, Yun-Long; Lan, You-Zhao; Wen, Yi-Hang
• Journal of publication: Crystal Growth & Design
• Year of publication: 2008
• Journal volume: 8
• Journal issue: 10
• Pages of publication: 3586
• a: 9.82 ± 0.002 Å
• b: 11.824 ± 0.002 Å
• c: 12.05 ± 0.002 Å
• α: 116.65 ± 0.03°
• β: 102.36 ± 0.03°
• γ: 96.21 ± 0.03°
• Cell volume: 1187.6 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0326
• Weighted residual factors for significantly intense reflections: 0.1061
• Weighted residual factors for all reflections included in the refinement: 0.1119
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No