Information card for entry 4083964

Structure parameters

• Formula: C43 H58 Eu F9 N6 O15.5 S3
• Calculated formula: C43 H58 Eu F9 N6 O15.5 S3
• Title of publication: Lanthanide Pybox Complexes as Catalysts for Enantioselective Silylcyanation of Aldehydes
• Authors of publication: Aspinall, Helen C.; Bickley, Jamie F.; Greeves, Nicholas; Kelly, Richard V.; Smith, Peter M.
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 14
• Pages of publication: 3458
• a: 21.661 ± 0.004 Å
• b: 22.288 ± 0.003 Å
• c: 25.488 ± 0.004 Å
• α: 90°
• β: 95.487 ± 0.019°
• γ: 90°
• Cell volume: 12249 ± 3 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 7
• 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: 0.2479
• Residual factor for significantly intense reflections: 0.1598
• Weighted residual factors for significantly intense reflections: 0.3941
• Weighted residual factors for all reflections included in the refinement: 0.4256
• Goodness-of-fit parameter for all reflections included in the refinement: 1.124
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No