Information card for entry 7025314

Structure parameters

• Formula: C35 H66 La N5 Si4
• Calculated formula: C35 H66 La N5 Si4
• SMILES: [La]12(N([Si](C)(C)C)[Si](C)(C)C)([N](=C(C)C=C(N1Cc1[n]2cccc1)C)c1c(cccc1C(C)C)C(C)C)N([Si](C)(C)C)[Si](C)(C)C
• Title of publication: Single, double and triple deprotonation of a beta-diketimine bearing pendant pyridyl group and the corresponding rare-earth metal complexes.
• Authors of publication: Xu, Xin; Chen, Yaofeng; Zou, Gang; Sun, Jie
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 16
• Pages of publication: 3952 - 3958
• a: 10.6794 ± 0.0018 Å
• b: 11.7544 ± 0.0019 Å
• c: 18.051 ± 0.003 Å
• α: 85.938 ± 0.003°
• β: 86.272 ± 0.003°
• γ: 81.21 ± 0.003°
• Cell volume: 2230.3 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0761
• Residual factor for significantly intense reflections: 0.0654
• Weighted residual factors for significantly intense reflections: 0.1587
• Weighted residual factors for all reflections included in the refinement: 0.1651
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No