Information card for entry 2222404

Structure parameters

• Chemical name: Tris(dibenzoylmethanido-κ^2^<i>O</i>,<i>O</i>')[(6<i>R</i>,8<i>R</i>)-(-)- 7,7-dimethyl-3-(2-pyridyl)-5,6,7,8-tetrahydro-6,8-methanoisoquinoline- κ^2^<i>N</i>,<i>N</i>']terbium(III)
• Formula: C62 H51 N2 O6 Tb
• Calculated formula: C62 H51 N2 O6 Tb
• SMILES: c1[n]2[Tb]345([O]=C(c6ccccc6)C=C(O3)c3ccccc3)([n]3c(c2ccc1)cc1c(c3)[C@H]2C([C@@H](C1)C2)(C)C)([O]=C(c1ccccc1)C=C(O4)c1ccccc1)OC(=CC(=[O]5)c1ccccc1)c1ccccc1
• Title of publication: Tris(dibenzoylmethanido-κ^2^<i>O</i>,<i>O</i>')[(6<i>R</i>,8<i>R</i>)-({-})-7,7-dimethyl-3-(2-pyridyl)-5,6,7,8-tetrahydro-6,8-methanoisoquinoline-κ^2^<i>N</i>,<i>N</i>']terbium(III)
• Authors of publication: Chen, Lei-Qi; Guo, Jian-Nan; Xuan, Wei-Min; Lin, Yi-Ji; Zhang, Hui
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 7
• Pages of publication: m705
• a: 9.5158 ± 0.0019 Å
• b: 20.79 ± 0.004 Å
• c: 12.769 ± 0.003 Å
• α: 90°
• β: 92.47 ± 0.03°
• γ: 90°
• Cell volume: 2523.8 ± 0.9 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0897
• Residual factor for significantly intense reflections: 0.0504
• Weighted residual factors for significantly intense reflections: 0.0778
• Weighted residual factors for all reflections included in the refinement: 0.0926
• Goodness-of-fit parameter for all reflections included in the refinement: 0.949
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes