Information card for entry 7228883

Structure parameters

• Formula: C48 H30 N12 O16 Pr2
• Calculated formula: C48 H30 N12 O16 Pr2
• Title of publication: A luminescent metal‒organic framework as an ideal chemosensor for nitroaromatic compounds
• Authors of publication: He, Hongming; Chen, Si-Hang; Zhang, De-Yu; Yang, En-Cui; Zhao, Xiao-Jun
• Journal of publication: RSC Adv.
• Year of publication: 2017
• Journal volume: 7
• Journal issue: 62
• Pages of publication: 38871
• a: 24.8728 ± 0.0013 Å
• b: 14.1665 ± 0.0008 Å
• c: 22.8202 ± 0.0012 Å
• α: 90°
• β: 97.374 ± 0.002°
• γ: 90°
• Cell volume: 7974.4 ± 0.7 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0693
• Residual factor for significantly intense reflections: 0.0507
• Weighted residual factors for significantly intense reflections: 0.1073
• Weighted residual factors for all reflections included in the refinement: 0.1181
• Goodness-of-fit parameter for all reflections included in the refinement: 0.98
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No