Information card for entry 7025350

Structure parameters

• Formula: C8 H11 In S
• Calculated formula: C8 H11 In S
• Title of publication: Rationalizing oligomerization in dimethylindium(III) chalcogenolates (Me2InER') (E = O, S, Se): a structural and computational study.
• Authors of publication: Briand, Glen G.; Decken, Andreas; Hamilton, Nathan S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 16
• Pages of publication: 3833 - 3841
• a: 12.5789 ± 0.0019 Å
• b: 6.9213 ± 0.0011 Å
• c: 21.401 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1863.2 ± 0.5 ų
• Cell temperature: 198 ± 1 K
• Ambient diffraction temperature: 198 ± 1 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0362
• Residual factor for significantly intense reflections: 0.0219
• Weighted residual factors for significantly intense reflections: 0.0496
• Weighted residual factors for all reflections included in the refinement: 0.0591
• Goodness-of-fit parameter for all reflections included in the refinement: 1.149
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No