Information card for entry 4313156

Structure parameters

• Formula: Cu Ga3 K2 Se6
• Calculated formula: Cu Ga3 K2 Se6
• Title of publication: K2MM'3Se6 (M = Cu, Ag; M' = Ga, In), A New Series of Metal Chalcogenides with Chain-Sublayer-Chain Slabs:\ιnfty1[M'Se4]-\ιnfty2[(MSe4)(M'Se4)]-\ιnfty1[M'Se4]
• Authors of publication: Ma, Hong-Wei; Guo, Guo-Cong; Wang, Ming-Sheng; Zhou, Guo-Wei; Lin, Shan-Hou; Dong, Zhen-Chao; Huang, Jin-Shun
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Journal issue: 4
• Pages of publication: 1366 - 1370
• a: 11.0312 ± 0.0017 Å
• b: 11.05 ± 0.004 Å
• c: 20.808 ± 0.007 Å
• α: 90°
• β: 97.71 ± 0.019°
• γ: 90°
• Cell volume: 2513.5 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.042
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0511
• Weighted residual factors for all reflections included in the refinement: 0.0515
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No