Information card for entry 7217016

Structure parameters

• Formula: Ba3 Cu4 O S6 Sb
• Calculated formula: Ba3 Cu4 O S6 Sb
• Title of publication: Low Temperature Synthesis and Structures of the Alkaline Earth Metal Chalcogenides Ba3Cu4SbS6OH, BaCuSbS3 and BaCu2S2
• Authors of publication: Ma, Zhimin; Weng, Fan; Wang, Qiuran; Tang, Qun; Zhang, Ganghua; Chong, Zheng; Han, Ray P.S.; Huang, Fu Qiang
• Journal of publication: RSC Advances
• Year of publication: 2014
• a: 9.0609 ± 0.0004 Å
• b: 10.8497 ± 0.0005 Å
• c: 13.9398 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1370.39 ± 0.11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0805
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.0819
• Weighted residual factors for all reflections included in the refinement: 0.0925
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No