Information card for entry 4126511

Structure parameters

• Formula: Bi Cu2 O10 S Se
• Calculated formula: Bi Cu2 O10 S Se
• Title of publication: The Octa-Kagomé Lattice Compounds Showing Quantum Critical Behaviors: Spin Gap Ground State versus Antiferromagnetic Ordering.
• Authors of publication: Tang, Yingying; Peng, Cheng; Guo, Wenbin; Wang, Jun-Feng; Su, Gang; He, Zhangzhen
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2017
• a: 9.467 ± 0.002 Å
• b: 6.3083 ± 0.0012 Å
• c: 14.775 ± 0.003 Å
• α: 90°
• β: 115.242 ± 0.01°
• γ: 90°
• Cell volume: 798.1 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0381
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.0802
• Weighted residual factors for all reflections included in the refinement: 0.081
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No