Information card for entry 4088137

Structure parameters

• Formula: C15 H37 B2 O3 Sm
• Calculated formula: C15 H37 B2 O3 Sm
• Title of publication: Mixed Allyl‒Borohydride Lanthanide Complexes: Synthesis of Ln(BH4)2(C3H5)(THF)3 (Ln = Nd, Sm), Characterization, and Reactivity toward Polymerization
• Authors of publication: Fadlallah, Sami; Terrier, Michaël; Jones, Chloe; Roussel, Pascal; Bonnet, Fanny; Visseaux, Marc
• Journal of publication: Organometallics
• Year of publication: 2016
• Journal volume: 35
• Journal issue: 4
• Pages of publication: 456
• a: 9.6926 ± 0.0007 Å
• b: 13.7986 ± 0.0009 Å
• c: 14.8066 ± 0.0011 Å
• α: 90°
• β: 91.771 ± 0.004°
• γ: 90°
• Cell volume: 1979.4 ± 0.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0409
• Residual factor for significantly intense reflections: 0.0321
• Weighted residual factors for significantly intense reflections: 0.0402
• Weighted residual factors for all reflections included in the refinement: 0.0414
• Goodness-of-fit parameter for significantly intense reflections: 2.2
• Goodness-of-fit parameter for all reflections included in the refinement: 2.08
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No