Information card for entry 4503025

Structure parameters

• Formula: C28 H24 N2 O20 Zn3
• Calculated formula: C28 H24 N2 O20 Zn3
• Title of publication: Role of Temperature on Framework Dimensionality: Supramolecular Isomers of Zn3(RCOO)8Based Metal Organic Frameworks
• Authors of publication: Nagarkar, Sanjog S.; Chaudhari, Abhijeet K.; Ghosh, Sujit K.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2012
• Journal volume: 12
• Journal issue: 2
• Pages of publication: 572
• a: 12.7693 ± 0.001 Å
• b: 12.7842 ± 0.0009 Å
• c: 14.7758 ± 0.0011 Å
• α: 85.019 ± 0.002°
• β: 65.87 ± 0.001°
• γ: 89.613 ± 0.002°
• Cell volume: 2191.9 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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 all reflections: 0.0334
• Residual factor for significantly intense reflections: 0.0312
• Weighted residual factors for significantly intense reflections: 0.094
• Weighted residual factors for all reflections included in the refinement: 0.0958
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No