Information card for entry 4349758

Structure parameters

• Chemical name: VNU-17
• Formula: C24 H8 I0 N0 O22.12 S2 Zr3
• Calculated formula: C24 H8 O22.12 S2 Zr3
• Title of publication: An anchoring strategy leads to enhanced proton conductivity in a new metal‒organic framework
• Authors of publication: Lo, Tien H. N.; Nguyen, My V.; Tu, Thach N.
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2017
• Journal volume: 4
• Journal issue: 9
• Pages of publication: 1509
• a: 17.7506 ± 0.0005 Å
• b: 17.7506 ± 0.0005 Å
• c: 22.4863 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7085.1 ± 0.4 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 K
• Number of distinct elements: 7
• Space group number: 87
• Hermann-Mauguin space group symbol: I 4/m
• Hall space group symbol: -I 4
• Residual factor for all reflections: 0.1583
• Residual factor for significantly intense reflections: 0.1196
• Weighted residual factors for significantly intense reflections: 0.2832
• Weighted residual factors for all reflections included in the refinement: 0.3062
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No