Information card for entry 7213865

Structure parameters

• Formula: C18 H20 Cd Cl2 N2 O5
• Calculated formula: C18 H14 Cd Cl2 N2 O5
• Title of publication: Anion-induced structural transformation involving interpenetration control and luminescence switching
• Authors of publication: Ren, Cai-Xia; Zheng, Ai-Li; Cai, Li-Xuan; Chen, Cheng; Tan, Bin; Zhang, Jie
• Journal of publication: CrystEngComm
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 6
• Pages of publication: 1038
• a: 15.971 ± 0.004 Å
• b: 16.246 ± 0.003 Å
• c: 16.318 ± 0.004 Å
• α: 90°
• β: 103.582 ± 0.014°
• γ: 90°
• Cell volume: 4115.5 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0508
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for significantly intense reflections: 0.1181
• Weighted residual factors for all reflections included in the refinement: 0.1272
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No