Information card for entry 7045354

Structure parameters

• Formula: C33 H37 N2 O8 Zn
• Calculated formula: C33 H37 N2 O8 Zn
• Title of publication: Three Zn(ii)-based MOFs for luminescence sensing of Fe³⁺ and Cr₂O₇^2- ions.
• Authors of publication: Xiao, Zhi-Zun; Han, Li-Juan; Wang, Zhong-Jie; Zheng, He-Gen
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 10
• Pages of publication: 3298 - 3302
• a: 9.2019 ± 0.0004 Å
• b: 13.4743 ± 0.0006 Å
• c: 25.3334 ± 0.001 Å
• α: 90°
• β: 90.4121 ± 0.0011°
• γ: 90°
• Cell volume: 3141 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0456
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for significantly intense reflections: 0.0883
• Weighted residual factors for all reflections included in the refinement: 0.0935
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No