Information card for entry 7000377

Structure parameters

• Formula: C12 H12 O4 Zn
• Calculated formula: C12 H12 O4 Zn
• Title of publication: A new luminescent 3D metal‒organic framework possessing a rare (3,5)-connected net which can be transformed from a 2D double layer
• Authors of publication: He, Haiyan; Dai, Fangna; Sun, Daofeng
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 5
• Pages of publication: 763 - 766
• a: 8.813 ± 0.001 Å
• b: 16.3419 ± 0.0018 Å
• c: 17.301 ± 0.002 Å
• α: 90°
• β: 103.185 ± 0.002°
• γ: 90°
• Cell volume: 2426 ± 0.5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0476
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for significantly intense reflections: 0.0935
• Weighted residual factors for all reflections included in the refinement: 0.1
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No