Information card for entry 7236100

Structure parameters

• Formula: C30 H30 N2 O20 Zn4
• Calculated formula: C30 H22 N2 O20 Zn4
• Title of publication: Rapid and discriminative detection of nitro aromatic compounds with high sensitivity using two zinc MOFs synthesized through a temperature-modulated method
• Authors of publication: Wan, Xiu-Yan; Jiang, Fei-Long; Liu, Cai-Ping; Zhou, Kang; Chen, Lian; Gai, Yan-Li; Yang, Yan; Hong, Mao-Chun
• Journal of publication: Journal of Materials Chemistry A
• Year of publication: 2015
• Journal volume: 3
• Journal issue: 44
• Pages of publication: 22369
• a: 7.8732 ± 0.0004 Å
• b: 9.6571 ± 0.0004 Å
• c: 12.1461 ± 0.0006 Å
• α: 76.894 ± 0.004°
• β: 89.325 ± 0.004°
• γ: 77.575 ± 0.004°
• Cell volume: 877.71 ± 0.07 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173.02 ± 0.16 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: 0.0328
• Residual factor for significantly intense reflections: 0.027
• Weighted residual factors for significantly intense reflections: 0.0746
• Weighted residual factors for all reflections included in the refinement: 0.0785
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No