Information card for entry 7049596

Structure parameters

• Formula: C46 H58 Al2 N4 O S
• Calculated formula: C46 H58 Al2 N4 O S
• Title of publication: Reactivity patterns for the activation of CO₂ and CS₂ with alumoxane and aluminum hydrides.
• Authors of publication: González-Gallardo, Sandra; Jancik, Vojtech; Díaz-Gómez, Dalia G; Cortés-Guzmán, Fernando; Hernández-Balderas, Uvaldo; Moya-Cabrera, Mónica
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 17
• Pages of publication: 5595 - 5603
• a: 8.57 ± 0.001 Å
• b: 9.899 ± 0.002 Å
• c: 13.425 ± 0.002 Å
• α: 71.329 ± 0.002°
• β: 80.812 ± 0.002°
• γ: 77.725 ± 0.002°
• Cell volume: 1049.1 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0568
• Residual factor for significantly intense reflections: 0.0516
• Weighted residual factors for significantly intense reflections: 0.1179
• Weighted residual factors for all reflections included in the refinement: 0.1208
• Goodness-of-fit parameter for all reflections included in the refinement: 1.134
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No