Information card for entry 4088079

Structure parameters

• Formula: C34 H57 Eu N4 O2
• Calculated formula: C34 H57 Eu N4 O2
• SMILES: [Eu]123456([O]7CCCC7)([n]7n1c(cc7C)C(C)(C)C)([c]1([c]2([c]3([c]5([c]61C)C)C)C)C)([O]1CCCC1)n1[n]4c(cc1C)C(C)(C)C
• Title of publication: Ln(II)/Pb(II)‒Ln(III)/Pb(0) Redox Approach toward Rare-Earth-Metal Half-Sandwich Complexes
• Authors of publication: Bienfait, André M.; Wolf, Benjamin M.; Törnroos, Karl W.; Anwander, Reiner
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 24
• Pages of publication: 5734
• a: 9.8752 ± 0.0011 Å
• b: 19.575 ± 0.002 Å
• c: 18.055 ± 0.002 Å
• α: 90°
• β: 95.314 ± 0.001°
• γ: 90°
• Cell volume: 3475.2 ± 0.7 ų
• Cell temperature: 102 ± 2 K
• Ambient diffraction temperature: 102 ± 2 K
• Number of distinct elements: 5
• 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: 0.047
• Residual factor for significantly intense reflections: 0.0413
• Weighted residual factors for significantly intense reflections: 0.1058
• Weighted residual factors for all reflections included in the refinement: 0.1119
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No