Information card for entry 7134142

Structure parameters

• Formula: C54 H74 Ce2 O4 S2
• Calculated formula: C54 H74 Ce2 O4 S2
• Title of publication: Cerium(III) yldiide complexes with divergent CO reactivity.
• Authors of publication: Gremillion, Alexander J.; Kumar, Hemant; Del Rosal, Iker; Kelley, Steven P.; Maron, Laurent; Gessner, Viktoria H.; Walensky, Justin R.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 4
• Pages of publication: 752 - 755
• a: 10.4042 ± 0.0005 Å
• b: 10.5714 ± 0.0005 Å
• c: 23.8222 ± 0.0011 Å
• α: 90°
• β: 98.2743 ± 0.0016°
• γ: 90°
• Cell volume: 2592.9 ± 0.2 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 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: 0.0497
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.0743
• Weighted residual factors for all reflections included in the refinement: 0.081
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No