Information card for entry 7022039

Structure parameters

• Formula: C68 H92 Cl2 N4 O4 Si4 Y2
• Calculated formula: C68 H92 Cl2 N4 O4 Si4 Y2
• SMILES: c12ccc3c(c1c1c(ccc4ccccc14)N([Si](C)(C)C)[Y]1(N2[Si](C)(C)C)([Cl][Y]2(N([Si](C)(C)C)c4ccc5ccccc5c4c4c(ccc5ccccc45)N2[Si](C)(C)C)([O]2CCCC2)([Cl]1)[O]1CCCC1)([O]1CCCC1)[O]1CCCC1)cccc3
• Title of publication: LiCl-effect on asymmetric intramolecular hydroamination catalyzed by binaphthylamido yttrium complexes.
• Authors of publication: Chapurina, Yulia; Guillot, Régis; Lyubov, Dmitrii; Trifonov, Alexander; Hannedouche, Jérôme; Schulz, Emmanuelle
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 2
• Pages of publication: 507 - 520
• a: 11.6878 ± 0.0009 Å
• b: 29.465 ± 0.003 Å
• c: 20.484 ± 0.002 Å
• α: 90°
• β: 100.581 ± 0.002°
• γ: 90°
• Cell volume: 6934.4 ± 1.1 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 7
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1694
• Residual factor for significantly intense reflections: 0.0918
• Weighted residual factors for significantly intense reflections: 0.2065
• Weighted residual factors for all reflections included in the refinement: 0.2552
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No