Information card for entry 7000336

Structure parameters

• Formula: C62 H80 Lu N10 P Si2
• Calculated formula: C62 H80 Lu N10 P Si2
• SMILES: c12ccccc1CN(c1c(cccc1C)C)[Lu]134([N](N=[N]1c1c(cc(cc1C)C)C)=P2(c1ccccc1)c1ccccc1)(N(C[Si](C)(C)C)[N]3=Nc1c(cc(cc1C)C)C)N(C[Si](C)(C)C)[N]4=Nc1c(cc(cc1C)C)C
• Title of publication: Rare-earth metal complexes stabilized by amino-phosphine ligand. Reaction with mesityl azide and catalysis of the cycloaddition of organic azides and aromatic alkynes
• Authors of publication: Liu, Bo; Cui, Dongmei
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 3
• Pages of publication: 550 - 556
• a: 12.1586 ± 0.001 Å
• b: 21.8677 ± 0.0017 Å
• c: 12.826 ± 0.001 Å
• α: 90°
• β: 112.504 ± 0.001°
• γ: 90°
• Cell volume: 3150.5 ± 0.4 ų
• Cell temperature: 187 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.069
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.0925
• Weighted residual factors for all reflections included in the refinement: 0.0981
• Goodness-of-fit parameter for all reflections included in the refinement: 0.868
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No