Information card for entry 7122026

Structure parameters

• Chemical name: [Y(BH4)3(THF)3]
• Formula: C12 H34.42 B2.61 I0.4 O3 Y
• Calculated formula: C12 H34.424 B2.606 I0.394 O3 Y
• Title of publication: Terbocenium: completing a heavy lanthanide metallocenium cation family with an alternative anion abstraction strategy.
• Authors of publication: Goodwin, Conrad A. P.; Reta, Daniel; Ortu, Fabrizio; Liu, Jingjing; Chilton, Nicholas F.; Mills, David P.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 66
• Pages of publication: 9182 - 9185
• a: 8.9188 ± 0.0002 Å
• b: 12.5674 ± 0.0003 Å
• c: 16.2017 ± 0.0004 Å
• α: 90°
• β: 91.122 ± 0.002°
• γ: 90°
• Cell volume: 1815.64 ± 0.07 ų
• Cell temperature: 150.11 ± 0.02 K
• Ambient diffraction temperature: 150.11 ± 0.02 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0949
• Residual factor for significantly intense reflections: 0.0715
• Weighted residual factors for significantly intense reflections: 0.169
• Weighted residual factors for all reflections included in the refinement: 0.1882
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No