Information card for entry 7701629

Structure parameters

• Formula: C12 H21 Ga O3 S6
• Calculated formula: C12 H21 Ga O3 S6
• Title of publication: Accessing γ-Ga₂S₃ by solventless thermolysis of gallium xanthates: a low-temperature limit for crystalline products.
• Authors of publication: Alderhami, Suliman A.; Collison, David; Lewis, David J.; McNaughter, Paul D.; O'Brien, Paul; Spencer, Ben F.; Vitorica-Yrezabal, Inigo; Whitehead, George
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 41
• Pages of publication: 15605 - 15612
• a: 12.6145 ± 0.001 Å
• b: 16.074 ± 0.0006 Å
• c: 10.4356 ± 0.0006 Å
• α: 90°
• β: 112.665 ± 0.008°
• γ: 90°
• Cell volume: 1952.6 ± 0.2 ų
• Cell temperature: 149.99 ± 0.1 K
• Ambient diffraction temperature: 149.99 ± 0.1 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: 0.0638
• Residual factor for significantly intense reflections: 0.0322
• Weighted residual factors for significantly intense reflections: 0.0537
• Weighted residual factors for all reflections included in the refinement: 0.0597
• Goodness-of-fit parameter for all reflections included in the refinement: 0.997
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No