Information card for entry 4328866

Structure parameters

• Formula: C24 H32 N14 O10 Zn
• Calculated formula: C24 H32 N14 O10 Zn
• Title of publication: Combination of Magnetic Susceptibility and Electron Paramagnetic Resonance to Monitor the 1D to 2D Solid State Transformation in Flexible Metal-Organic Frameworks of Co(II) and Zn(II) with 1,4-Bis(triazol-1-ylmethyl)benzene
• Authors of publication: Eugenio Coronado; Mónica Giménez-Marqués; Guillermo Mínguez Espallargas
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 4403 - 4410
• a: 9.0695 ± 0.0007 Å
• b: 9.3491 ± 0.0007 Å
• c: 10.5511 ± 0.0008 Å
• α: 80.933 ± 0.006°
• β: 75.831 ± 0.007°
• γ: 61.733 ± 0.008°
• Cell volume: 763.08 ± 0.12 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0794
• Residual factor for significantly intense reflections: 0.0394
• Weighted residual factors for significantly intense reflections: 0.0554
• Weighted residual factors for all reflections included in the refinement: 0.0599
• Goodness-of-fit parameter for all reflections included in the refinement: 0.777
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No