Information card for entry 2013676

Structure parameters

• Common name: cadmium zinc borate
• Chemical name: tricadmium trizinc tetraborate
• Formula: B4 Cd3 O12 Zn3
• Calculated formula: B4 Cd3 O12 Zn3
• Title of publication: A non-linear optical crystal, Cd~3~Zn~3~(BO~3~)~4~
• Authors of publication: Sun, Tongqing; Pan, Feng; Wang, Ruji; Shen, Guangqiu; Wang, Xiaoqing; Shen, Dezhong
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 11
• Pages of publication: i107 - i108
• a: 8.364 ± 0.006 Å
• b: 8.364 ± 0.006 Å
• c: 12.286 ± 0.01 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 744.3 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 161
• Hermann-Mauguin space group symbol: R 3 c :H
• Hall space group symbol: R 3 -2"c
• Residual factor for all reflections: 0.06
• Residual factor for significantly intense reflections: 0.052
• Weighted residual factors for significantly intense reflections: 0.113
• Weighted residual factors for all reflections included in the refinement: 0.121
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes