Information card for entry 7022037

Structure parameters

• Formula: C44 H71 N2 O2 Si3 Y
• Calculated formula: C44 H71 N2 O2 Si3 Y
• SMILES: C[Si](C)(C)C[Y]1(N([Si](C)(C)C)c2(c(c3c4c(ccc3N1[Si](C)(C)C)cccc4)c1c(cc2)cccc1))([O]1CCCC1)[O]1CCCC1.CCCCCC
• 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: 10.5117 ± 0.0003 Å
• b: 13.7159 ± 0.0004 Å
• c: 17.3224 ± 0.0004 Å
• α: 78.113 ± 0.001°
• β: 76.911 ± 0.001°
• γ: 89.739 ± 0.001°
• Cell volume: 2378.12 ± 0.11 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 6
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0566
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.1187
• Weighted residual factors for all reflections included in the refinement: 0.1247
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No