Information card for entry 4065423

Structure parameters

• Formula: C54 H104 N6 O2 Si4 Y2
• Calculated formula: C54 H104 N6 O2 Si4 Y2
• SMILES: [Y]123(N([Si](C)(C)C)[Si](C)(C)C)[N](C(C)C)=C4[N]1(C(C)C)[Y]1(N([Si](C)(C)C)[Si](C)(C)C)([N](C(C)C)=C(c5c(O2)c(cc(c5)C(C)(C)C)C(C)(C)C)[N]13C(C)C)Oc1c(cc(cc41)C(C)(C)C)C(C)(C)C
• Title of publication: Rare-Earth Complexes with Multidentate Tethered Phenoxy-Amidinate Ligands: Synthesis, Structure, and Activity in Ring-Opening Polymerization of Lactide
• Authors of publication: Sinenkov, Mikhail; Kirillov, Evgeny; Roisnel, Thierry; Fukin, Georgy; Trifonov, Alexander; Carpentier, Jean-François
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 20
• Pages of publication: 5509
• a: 18.4284 ± 0.0016 Å
• b: 14.7704 ± 0.0011 Å
• c: 27.969 ± 0.002 Å
• α: 90°
• β: 96.778 ± 0.003°
• γ: 90°
• Cell volume: 7559.8 ± 1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1556
• Residual factor for significantly intense reflections: 0.069
• Weighted residual factors for significantly intense reflections: 0.1513
• Weighted residual factors for all reflections included in the refinement: 0.1711
• Goodness-of-fit parameter for all reflections included in the refinement: 0.937
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No