Information card for entry 2311539

Structure parameters

• Chemical name: <i>trans</i>-4,8-Bis(3,5-diisopropylpyrazoly-1-yl)-1,3,5,7-tetraisopropylpyrazabole
• Formula: C36 H62 B2 N8
• Calculated formula: C36 H62 B2 N8
• Title of publication: Formation and structural characterization of a europium(II) mono(scorpionate) complex and a sterically crowded pyraza-bole.
• Authors of publication: Liebing, Phil; Kühling, Marcel; Takats, Josef; Hilfert, Liane; Edelmann, Frank T.
• Journal of publication: Acta crystallographica. Section E, Crystallographic communications
• Year of publication: 2017
• Journal volume: 73
• Journal issue: Pt 12
• Pages of publication: 1921 - 1925
• a: 25.7646 ± 0.0011 Å
• b: 11.2134 ± 0.0003 Å
• c: 15.0968 ± 0.0007 Å
• α: 90°
• β: 118.792 ± 0.003°
• γ: 90°
• Cell volume: 3822.4 ± 0.3 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.065
• Residual factor for significantly intense reflections: 0.0435
• Weighted residual factors for significantly intense reflections: 0.096
• Weighted residual factors for all reflections included in the refinement: 0.1038
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No