Information card for entry 7048766

Structure parameters

• Formula: C106 H138 O26 Si4 Sr4 Ti2
• Calculated formula: C106 H138 O26 Si4 Sr4 Ti2
• Title of publication: Transformation of molecular compounds with Ba(Sr)/Al/Si and Ca(Sr, Ba)/Ti(Zr, Hf)/Si heteroelements as new efficient route to metal silicate materials.
• Authors of publication: Petrus, R.; Drąg-Jarząbek, A; Utko, J.; Lis, T.; Sobota, P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 13
• Pages of publication: 4283 - 4298
• a: 14.926 ± 0.004 Å
• b: 14.964 ± 0.004 Å
• c: 15.66 ± 0.004 Å
• α: 107.74 ± 0.03°
• β: 95.45 ± 0.02°
• γ: 118.92 ± 0.03°
• Cell volume: 2790 ± 1.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1025
• Residual factor for significantly intense reflections: 0.0647
• Weighted residual factors for significantly intense reflections: 0.1421
• Weighted residual factors for all reflections included in the refinement: 0.1684
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No