Information card for entry 7710296

Structure parameters

• Formula: C53 H72 N3 Y
• Calculated formula: C53 H72 N3 Y
• Title of publication: π-Carbazolyl supported bis(alkyl) complexes of Sc, Y and La for α-olefin polymerization and hydrogenation
• Authors of publication: Trifonov, Alexander; Selikhov, Alexander N.; Pechenkina, Polina; Cherkasov, Anton; Nelyubina, Yulia V.; Glukhova, Tatyana
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 21.112 ± 0.013 Å
• b: 12.629 ± 0.008 Å
• c: 18.607 ± 0.011 Å
• α: 90°
• β: 107.171 ± 0.01°
• γ: 90°
• Cell volume: 4740 ± 5 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• 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: 0.2129
• Residual factor for significantly intense reflections: 0.0806
• Weighted residual factors for significantly intense reflections: 0.1258
• Weighted residual factors for all reflections included in the refinement: 0.1616
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No