Information card for entry 7206293

Structure parameters

• Formula: C29 H22 N2 O4 Zn
• Calculated formula: C29 H22 N2 O4 Zn
• Title of publication: Cadmium(ii) and zinc(ii) metal‒organic frameworks with anthracene-based dicarboxylic ligands: solvothermal synthesis, crystal structures, and luminescent properties
• Authors of publication: Wang, Jun-Jie; Hu, Tong-Liang; Bu, Xian-He
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 16
• Pages of publication: 5152
• a: 18.327 ± 0.004 Å
• b: 11.613 ± 0.002 Å
• c: 22.078 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4698.9 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1213
• Residual factor for significantly intense reflections: 0.0719
• Weighted residual factors for significantly intense reflections: 0.1515
• Weighted residual factors for all reflections included in the refinement: 0.175
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No