Information card for entry 1549299

Structure parameters

• Common name: Cp"2Th(III)Alanate
• Chemical name: Cp"2Th(III)Alanate
• Formula: C36 H72 Al Si3 Th
• Calculated formula: C36 H72 Al Si2.9988 Th
• Title of publication: Chemical structure and bonding in a thorium(iii)-aluminum heterobimetallic complex.
• Authors of publication: Altman, Alison B.; Brown, Alexandra C.; Rao, Guodong; Lohrey, Trevor D.; Britt, R. David; Maron, Laurent; Minasian, Stefan G.; Shuh, David K.; Arnold, John
• Journal of publication: Chemical science
• Year of publication: 2018
• Journal volume: 9
• Journal issue: 18
• Pages of publication: 4317 - 4324
• a: 12.933 ± 0.008 Å
• b: 12.816 ± 0.008 Å
• c: 13.179 ± 0.008 Å
• α: 90°
• β: 94.46 ± 0.004°
• γ: 90°
• Cell volume: 2178 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.028
• Residual factor for significantly intense reflections: 0.024
• Weighted residual factors for significantly intense reflections: 0.0571
• Weighted residual factors for all reflections included in the refinement: 0.0588
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.7749 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No