Information card for entry 4112790

Structure parameters

• Formula: C159 H218 B2 N4 O6.5 Si2 Y2
• Calculated formula: C154 H208 B2 N4 O6 Si2 Y2
• SMILES: [Y]1([O]2CCCC2)([O]2CCCC2)([O]2CCCC2)([N](c2c(cccc2C(C)C)C(C)C)=C(N1c1c(cccc1C(C)C)C(C)C)c1ccccc1)C[Si](C)(C)C.c1(ccccc1)[B-](c1ccccc1)(c1ccccc1)c1ccccc1.C1CCCCC1
• Title of publication: One Ligand Fits All: Cationic Mono(amidinate) Alkyl Catalysts over the Full Size Range of the Group 3 and Lanthanide Metals
• Authors of publication: Sergio Bambirra; Marco W. Bouwkamp; Auke Meetsma; Bart Hessen
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2004
• Journal volume: 126
• Pages of publication: 9182 - 9183
• a: 13.3902 ± 0.0006 Å
• b: 22.711 ± 0.001 Å
• c: 25.732 ± 0.001 Å
• α: 75.174 ± 0.001°
• β: 85.179 ± 0.001°
• γ: 74.6 ± 0.001°
• Cell volume: 7292 ± 0.5 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1791
• Residual factor for significantly intense reflections: 0.0807
• Weighted residual factors for significantly intense reflections: 0.1702
• Weighted residual factors for all reflections included in the refinement: 0.199
• Goodness-of-fit parameter for all reflections included in the refinement: 0.902
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No