Information card for entry 7045167

Structure parameters

• Formula: C28 H33 N O19 Zn3
• Calculated formula: C28 H33 N O19 Zn3
• Title of publication: Four new metal-organic frameworks based on diverse secondary building units: sensing and magnetic properties.
• Authors of publication: Yan, Yang-Tian; Zhang, Wen-Yan; Zhang, Fang; Cao, Feng; Yang, Rui-Feng; Wang, Yao-Yu; Hou, Lei
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 5
• Pages of publication: 1682 - 1692
• a: 8.637 ± 0.001 Å
• b: 20.398 ± 0.002 Å
• c: 18.307 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3225.3 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.054
• Residual factor for significantly intense reflections: 0.0521
• Weighted residual factors for significantly intense reflections: 0.1351
• Weighted residual factors for all reflections included in the refinement: 0.1371
• Goodness-of-fit parameter for all reflections included in the refinement: 1.164
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No