Information card for entry 7206291

Structure parameters

• Formula: C10 H12 Cd Cl2 N O2
• Calculated formula: C10 H12 Cd Cl2 N O2
• 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: 7.2223 ± 0.0014 Å
• b: 8.2583 ± 0.0017 Å
• c: 11.575 ± 0.002 Å
• α: 104.61 ± 0.03°
• β: 101.05 ± 0.03°
• γ: 99.64 ± 0.03°
• Cell volume: 638.5 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0447
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for significantly intense reflections: 0.0539
• Weighted residual factors for all reflections included in the refinement: 0.0568
• Goodness-of-fit parameter for all reflections included in the refinement: 1.123
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No