Information card for entry 1548920

Structure parameters

• Chemical name: Th(OC(CH2)SiMe3)(BIMA)3
• Formula: C29 H62 N6 O Si Th
• Calculated formula: C29 H62 N6 O Si Th
• SMILES: [Th]123(OC(=C)[Si](C)(C)C)(N(C(C)C)C(=[N]1C(C)C)C)([N](C(C)C)=C(N2C(C)C)C)[N](C(C)C)=C(N3C(C)C)C
• Title of publication: Insertion, protonolysis and photolysis reactivity of a thorium monoalkyl amidinate complex.
• Authors of publication: Settineri, Nicholas S.; Arnold, John
• Journal of publication: Chemical science
• Year of publication: 2018
• Journal volume: 9
• Journal issue: 10
• Pages of publication: 2831 - 2841
• a: 12.986 ± 0.004 Å
• b: 16.992 ± 0.005 Å
• c: 17.337 ± 0.004 Å
• α: 103.843 ± 0.01°
• β: 97.592 ± 0.01°
• γ: 93.871 ± 0.012°
• Cell volume: 3662.3 ± 1.8 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: 0.0347
• Residual factor for significantly intense reflections: 0.0273
• Weighted residual factors for significantly intense reflections: 0.0556
• Weighted residual factors for all reflections included in the refinement: 0.0585
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No