Information card for entry 7054438

Structure parameters

• Formula: B3 Cd4 O10 Yb
• Calculated formula: B3 Cd4 O10 Yb
• Title of publication: Synthesis and characterization of Cd4YbO(BO3)3‒ a congruent melting cadmium‒ytterbium oxyborate with large nonlinear optical properties
• Authors of publication: Zou, Guohong; Huang, Ling; Cai, Huaqiang; Wang, Shichao; Ye, Ning
• Journal of publication: New J. Chem.
• Year of publication: 2014
• Journal volume: 38
• Journal issue: 12
• Pages of publication: 6186
• a: 7.938 ± 0.004 Å
• b: 15.794 ± 0.007 Å
• c: 3.4414 ± 0.0015 Å
• α: 90°
• β: 99.992 ± 0.009°
• γ: 90°
• Cell volume: 424.9 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 8
• Hermann-Mauguin space group symbol: C 1 m 1
• Hall space group symbol: C -2y
• Residual factor for all reflections: 0.0545
• Residual factor for significantly intense reflections: 0.0527
• Weighted residual factors for significantly intense reflections: 0.1367
• Weighted residual factors for all reflections included in the refinement: 0.138
• Goodness-of-fit parameter for all reflections included in the refinement: 1.111
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No