Information card for entry 7047679

Structure parameters

• Formula: C42 H44 N4 O15 Zn2
• Calculated formula: C35 H24 N2 O11 Zn2
• Title of publication: Novel metal-organic frameworks with high stability for selectively sensing nitroaromatics.
• Authors of publication: Liu, Yi; Zhao, Yue; Liu, Xiao-Hui; Kang, Yan-Shang; Wang, Peng; Sun, Wei-Yin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 43
• Pages of publication: 15399 - 15404
• a: 20.228 ± 0.003 Å
• b: 16.09 ± 0.002 Å
• c: 14.644 ± 0.002 Å
• α: 90°
• β: 99.626 ± 0.002°
• γ: 90°
• Cell volume: 4699.1 ± 1.1 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0716
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.155
• Weighted residual factors for all reflections included in the refinement: 0.1893
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No