Information card for entry 2001605

Structure parameters

• Formula: S4 V3
• Calculated formula: S4 V3
• SMILES: [V+3].[V+3].[V+2].[S-2].[S-2].[S-2].[S-2]
• Title of publication: Structure of hexagonal V~3~S~4~ determined at three different temperatures
• Authors of publication: Bensch, W.; Koy, J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 6
• Pages of publication: 1133 - 1135
• a: 9.118 ± 0.001 Å
• b: 9.118 ± 0.001 Å
• c: 3.3035 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 237.85 ± 0.07 ų
• Cell temperature: 295 K
• Number of distinct elements: 2
• Hermann-Mauguin space group symbol: P 63/m
• Hall space group symbol: -P 6c
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for significantly intense reflections: 0.0233
• Goodness-of-fit parameter for significantly intense reflections: 1.2
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No