Information card for entry 4082097

Structure parameters

• Formula: C102 H126 Lu2 N8 O8
• Calculated formula: C102 H126 Lu2 N8 O8
• SMILES: C1(c2ccccc2)=[N]([Lu]2345(N1c1c(cccc1C(C)C)C(C)C)[O]=C(Cc1c(cccc1)N(C)C)O[Lu]16([N](c7c(cccc7C(C)C)C(C)C)=C(c7ccccc7)N1c1c(cccc1C(C)C)C(C)C)([O]3C(=[O]5)Cc1c(N(C)C)cccc1)([O]4C(=[O]6)Cc1c(N(C)C)cccc1)[O]=C(O2)Cc1c(N(C)C)cccc1)c1c(C(C)C)cccc1C(C)C
• Title of publication: Synthesis, Structural Characterization, and Reactivity of Mono(amidinate) Rare-Earth-Metal Bis(aminobenzyl) Complexes
• Authors of publication: Hong, Jianquan; Zhang, Lixin; Wang, Kai; Chen, Zhenxia; Wu, Limin; Zhou, Xigeng
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 24
• Pages of publication: 7312
• a: 12.928 ± 0.005 Å
• b: 17.463 ± 0.006 Å
• c: 24.005 ± 0.009 Å
• α: 90°
• β: 93.523 ± 0.005°
• γ: 90°
• Cell volume: 5409 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0759
• Residual factor for significantly intense reflections: 0.0433
• Weighted residual factors for significantly intense reflections: 0.0699
• Weighted residual factors for all reflections included in the refinement: 0.073
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No