Information card for entry 7045862

Structure parameters

• Formula: C69 H100 N2 O Si2 Th
• Calculated formula: C69 H100 N2 O Si2 Th
• Title of publication: Thorium(iv) alkyl and allyl complexes of a rigid NON-donor pincer ligand with flanking 1-adamantyl substituents.
• Authors of publication: Andreychuk, Nicholas R.; Dickie, Tara; Emslie, David J. H.; Jenkins, Hilary A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 14
• Pages of publication: 4866 - 4876
• a: 11.71 ± 0.0012 Å
• b: 11.8425 ± 0.0012 Å
• c: 23.928 ± 0.003 Å
• α: 82.182 ± 0.002°
• β: 76.962 ± 0.002°
• γ: 78.177 ± 0.002°
• Cell volume: 3150 ± 0.6 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: 0.0567
• Residual factor for significantly intense reflections: 0.0539
• Weighted residual factors for significantly intense reflections: 0.1445
• Weighted residual factors for all reflections included in the refinement: 0.1457
• Goodness-of-fit parameter for all reflections included in the refinement: 1.286
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No