Information card for entry 7227642

Structure parameters

• Formula: C62 H52 Cd2 N8 O16
• Calculated formula: C62 H52 Cd2 N8 O16
• Title of publication: Fluorescence detection of Mn2+, Cr2O72− and nitroexplosives and photocatalytic degradation of methyl violet and rhodamine B based on two stable metal‒organic frameworks
• Authors of publication: Wu, Yu; Wu, Jian; Luo, Zhidong; Wang, Jun; Li, Yulong; Han, Yaoyao; Liu, Jianqiang
• Journal of publication: RSC Adv.
• Year of publication: 2017
• Journal volume: 7
• Journal issue: 17
• Pages of publication: 10415
• a: 10.1676 ± 0.0016 Å
• b: 17.3 ± 0.003 Å
• c: 17.485 ± 0.003 Å
• α: 90°
• β: 91.708 ± 0.002°
• γ: 90°
• Cell volume: 3074.2 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0465
• Residual factor for significantly intense reflections: 0.0359
• Weighted residual factors for significantly intense reflections: 0.0951
• Weighted residual factors for all reflections included in the refinement: 0.1004
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No