Information card for entry 7047699

Structure parameters

• Formula: Ga Na3 S4 Zn
• Calculated formula: Ga Na3 S4 Zn
• Title of publication: Structural insights into T₂-cluster-containing chalcogenides with vertex-, edge- and face-sharing connection modes of NaQ₆ ligands: Na₃ZnM^IIIQ₄ (M^III = In, Ga; Q = S, Se).
• Authors of publication: Chen, Ruijiao; Wu, Xiaowen; Su, Zhi
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 43
• Pages of publication: 15538 - 15544
• a: 12.871 ± 0.01 Å
• b: 12.871 ± 0.01 Å
• c: 18.56 ± 0.03 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3075 ± 6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 142
• Hermann-Mauguin space group symbol: I 41/a c d :2
• Hall space group symbol: -I 4bd 2c
• Residual factor for all reflections: 0.0377
• Residual factor for significantly intense reflections: 0.0264
• Weighted residual factors for significantly intense reflections: 0.0565
• Weighted residual factors for all reflections included in the refinement: 0.0612
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No