Information card for entry 7701988

Structure parameters

• Formula: C36 H64 B4 N2 Sm2
• Calculated formula: C36 H58 B4 N2 Sm2
• Title of publication: Half-Sandwich Rare-Earth Metal Complexes Bearing a C5Me4-C6H4-o-CH2NMe2 Ligand: Synthesis, Characterization and Catalytic Properties for Isoprene, 1-Hexene and MMA Polymerization
• Authors of publication: Mu, Ying; Song, Tingting; Liu, Ning; Tong, Xiaobo; Li, Feng; Mu, Xiaoyue
• Journal of publication: Dalton Transactions
• Year of publication: 2019
• a: 8.6992 ± 0.0005 Å
• b: 12.417 ± 0.0007 Å
• c: 21.8057 ± 0.0012 Å
• α: 92.15 ± 0.001°
• β: 94.739 ± 0.001°
• γ: 96.583 ± 0.001°
• Cell volume: 2329.3 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0421
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.0989
• Weighted residual factors for all reflections included in the refinement: 0.1155
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No