Information card for entry 7044705

Structure parameters

• Formula: Ge3 Li3 Se6
• Calculated formula: Ge3 Li3 Se6
• Title of publication: Li3Ge3Se6: The First Ternary Lithium Germanium Selenide with Interesting ∞[Ge6Se12]n Chains Constructed by Ethane-like [Ge2Se6]6- Clusters
• Authors of publication: Li, Guangmao; Zhen, Ni; Chu, Yu; Zhou, Zhongxiang
• Journal of publication: Dalton Transactions
• Year of publication: 2017
• a: 6.7728 ± 0.0003 Å
• b: 8.6804 ± 0.0005 Å
• c: 10.63 ± 0.0005 Å
• α: 74.519 ± 0.004°
• β: 76.334 ± 0.004°
• γ: 69.185 ± 0.004°
• Cell volume: 555.98 ± 0.05 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0386
• Residual factor for significantly intense reflections: 0.0265
• Weighted residual factors for significantly intense reflections: 0.0471
• Weighted residual factors for all reflections included in the refinement: 0.0502
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No