Information card for entry 7123742

Structure parameters

• Common name: [(CpAr*)(Cp*)Th(PhCH-CC-CHPh)]
• Formula: C101 H132 Th
• Calculated formula: C101 H132 Th
• Title of publication: Monomeric Thorium Dihydrido Complex: A Versatile Precursor to Actinide Metallacycles
• Authors of publication: Qin, Guorui; Wang, Yang; Shi, Xianghui; del Rosal, Iker; Laurent, Maron; Cheng, Jianhua
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 14.7678 ± 0.0011 Å
• b: 15.0111 ± 0.0011 Å
• c: 23.5344 ± 0.0017 Å
• α: 108.004 ± 0.001°
• β: 90.791 ± 0.001°
• γ: 91.23 ± 0.001°
• Cell volume: 4959.4 ± 0.6 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0489
• Residual factor for significantly intense reflections: 0.0381
• Weighted residual factors for significantly intense reflections: 0.0854
• Weighted residual factors for all reflections included in the refinement: 0.0917
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No