Information card for entry 4502229

Structure parameters

• Formula: C3.25 Cd0.13 Li0.13 N0 O
• Calculated formula: C3.25 Cd0.125 Li0.125 O
• Title of publication: A Series of Cation-Templated, Polycarboxylate-Based Cd(II) or Cd(II)/Li(I) Frameworks with Second-Order Nonlinear Optical and Ferroelectric Properties
• Authors of publication: Lin, Jian-Di; Long, Xi-Fa; Lin, Ping; Du, Shao-Wu
• Journal of publication: Crystal Growth & Design
• Year of publication: 2010
• Journal volume: 10
• Journal issue: 1
• Pages of publication: 146
• a: 9.824 ± 0.002 Å
• b: 9.824 ± 0.002 Å
• c: 6.536 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 630.8 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 115
• Hermann-Mauguin space group symbol: P -4 m 2
• Hall space group symbol: P -4 -2
• Residual factor for all reflections: 0.0372
• Residual factor for significantly intense reflections: 0.0372
• Weighted residual factors for significantly intense reflections: 0.0927
• Weighted residual factors for all reflections included in the refinement: 0.0927
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No