Information card for entry 4340944

Structure parameters

• Formula: C38 H42 Cl N4 O16 Tb Zn2
• Calculated formula: C38 H42 Cl N4 O16 Tb Zn2
• SMILES: [Tb]123456([O]7[Zn]8([O]=C(O3)C)([O]=C(O4)C)[n]3ccccc3C[N]8=Cc3cccc([O]1CC)c73)[O]1[Zn]3([O]=C(O5)C)([O]=C(O6)C)[n]4ccccc4C[N]3=Cc3cccc([O]2CC)c13.Cl(=O)(=O)(=O)[O-]
• Title of publication: Anion-dependent assembly of four sensitized near-infrared luminescent heteronuclear Zn(II)-Yb(III) Schiff base complexes from a trinuclear Zn(II) complex.
• Authors of publication: Zheng, Zhi-Peng; Ou, Yan-Jun; Hong, Xu-Jia; Wei, Lei-Ming; Wan, Lin-Tao; Zhou, Wo-Hua; Zhan, Qing-Guang; Cai, Yue-Peng
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 18
• Pages of publication: 9625 - 9632
• a: 19.438 ± 0.003 Å
• b: 16.621 ± 0.003 Å
• c: 28.614 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9245 ± 3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0816
• Residual factor for significantly intense reflections: 0.0531
• Weighted residual factors for significantly intense reflections: 0.1555
• Weighted residual factors for all reflections included in the refinement: 0.1773
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No