Information card for entry 7048793

Structure parameters

• Formula: C70 H109 N P Th
• Calculated formula: C70 H109 N P Th
• Title of publication: A base-free terminal thorium phosphinidene metallocene and its reactivity toward selected organic molecules.
• Authors of publication: Zhang, Congcong; Hou, Guohua; Zi, Guofu; Walter, Marc D.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 7
• Pages of publication: 2377 - 2387
• a: 12.0224 ± 0.0005 Å
• b: 14.9397 ± 0.0006 Å
• c: 19.817 ± 0.0008 Å
• α: 68.243 ± 0.004°
• β: 82.483 ± 0.004°
• γ: 80.226 ± 0.004°
• Cell volume: 3248.8 ± 0.2 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.01 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0494
• Residual factor for significantly intense reflections: 0.0422
• Weighted residual factors for significantly intense reflections: 0.0981
• Weighted residual factors for all reflections included in the refinement: 0.1029
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No