Information card for entry 1560299

Structure parameters

• Formula: F6 O6 Sb4 Zn3
• Calculated formula: F6 O6 Sb4 Zn3
• Title of publication: Zn3Sb4O6F6: Hydrothermal synthesis, crystal structure and nonlinear optical properties
• Authors of publication: Sk Imran Alia; Weiguo Zhangb; P. Shiv Halasyamanib; Mats Johnsson
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2017
• Journal volume: 256
• Pages of publication: 158 - 161
• a: 8.1291 ± 0.0004 Å
• b: 8.1291 ± 0.0004 Å
• c: 8.1291 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 537.19 ± 0.05 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• Space group number: 217
• Hermann-Mauguin space group symbol: I -4 3 m
• Hall space group symbol: I -4 2 3
• Residual factor for all reflections: 0.0218
• Residual factor for significantly intense reflections: 0.0208
• Weighted residual factors for significantly intense reflections: 0.0253
• Weighted residual factors for all reflections included in the refinement: 0.0255
• Goodness-of-fit parameter for significantly intense reflections: 1.77
• Goodness-of-fit parameter for all reflections included in the refinement: 1.75
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No