Information card for entry 7030284

Structure parameters

• Formula: C2 H4 Ba O6 S2
• Calculated formula: C2 H4 Ba O6 S2
• Title of publication: Solvothermal synthesis and characterization of two inorganic-organic hybrid materials based on barium.
• Authors of publication: Abdollahian, Yashar; Hauser, Jesse L.; Rogow, David L.; Oliver, Allen G.; Oliver, Scott R. J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 40
• Pages of publication: 12630 - 12634
• a: 6.259 ± 0.0017 Å
• b: 8.266 ± 0.002 Å
• c: 7.411 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 383.42 ± 0.17 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 31
• Hermann-Mauguin space group symbol: P m n 21
• Hall space group symbol: P 2ac -2
• Residual factor for all reflections: 0.0345
• Residual factor for significantly intense reflections: 0.0335
• Weighted residual factors for significantly intense reflections: 0.0837
• Weighted residual factors for all reflections included in the refinement: 0.0838
• Goodness-of-fit parameter for all reflections included in the refinement: 1.22
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No