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Novel Copper(II) and Zinc(II) 2-D Supramolecular Structures Based on Carboxylate and 1-Substitutedimidazole Mixed-ligands

Novel Copper(II) and Zinc(II) 2-D Supramolecular Structures Based on Carboxylate and 1-Substitutedimidazole Mixed-ligands
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摘要 Using the ligand bis(3-(1H-imidazol-1-yl)-1-phenylpropan-1-one) L, two novel complexes [CuL2(ph))]·H2O 1 and [ZnL2(tp)] 2 (ph = phthalic acid, tp = terephthalic acid) have been synthesized and their crystal structures were determined by single-crystal X-ray diffraction analysis. Crystal data for 1: triclinic, space group P1^-, a = 9.4300(17), b = 12.148(2), c = 13.721(2) A, a = 109.620(2),β = 94.351(2), y = 94.830(2)°, C32H30N4O7Cu, Mr = 646.14, V= 1466.2(4) A^3, Z = 2, Dc = 1.464 g/cm3, It(MoKa) = 0.801 mm^-1, F(000) = 670, the final R = 0.0337 and wR = 0.0859 for 5122 observed reflections with I 〉 2σ(I), And those for 2: monoclinic, space group P2/n, a = 7.1866(11), b = 14.144(2), c = 14.407(2)/k, β = 101.427(2)°, C32H28N4O6Zn, Mr = 629.95, V = 1435.4(4) A3, Z = 2, Dc = 1.457 g/cm3, μ(MoKa) = 0.908 mm^-1, F(000) = 652, the final R = 0.0438 and wR= 0.0821 for 2546 observed reflections with I〉 2σ(I). In 1 and 2, ph or tp ligauds bridge the six-coordinated copper(Ⅱ) or four-coordinated zinc(Ⅱ) ions forming 1D zigzag chains while L ligands act as the terminal monodentate ligand. It is noted that weak non-classical C-H…O plays the important and dominating roles in the formation of 2D supramolecular architectures of 1, but in 2 non-classical C-H…O and aromatic π…π Stacking interactions are quite important and play dominant roles in the self-assembly of 2D supramolecular architectures. Using the ligand bis(3-(1H-imidazol-1-yl)-1-phenylpropan-1-one) L, two novel complexes [CuL2(ph))]·H2O 1 and [ZnL2(tp)] 2 (ph = phthalic acid, tp = terephthalic acid) have been synthesized and their crystal structures were determined by single-crystal X-ray diffraction analysis. Crystal data for 1: triclinic, space group P1^-, a = 9.4300(17), b = 12.148(2), c = 13.721(2) A, a = 109.620(2),β = 94.351(2), y = 94.830(2)°, C32H30N4O7Cu, Mr = 646.14, V= 1466.2(4) A^3, Z = 2, Dc = 1.464 g/cm3, It(MoKa) = 0.801 mm^-1, F(000) = 670, the final R = 0.0337 and wR = 0.0859 for 5122 observed reflections with I 〉 2σ(I), And those for 2: monoclinic, space group P2/n, a = 7.1866(11), b = 14.144(2), c = 14.407(2)/k, β = 101.427(2)°, C32H28N4O6Zn, Mr = 629.95, V = 1435.4(4) A3, Z = 2, Dc = 1.457 g/cm3, μ(MoKa) = 0.908 mm^-1, F(000) = 652, the final R = 0.0438 and wR= 0.0821 for 2546 observed reflections with I〉 2σ(I). In 1 and 2, ph or tp ligauds bridge the six-coordinated copper(Ⅱ) or four-coordinated zinc(Ⅱ) ions forming 1D zigzag chains while L ligands act as the terminal monodentate ligand. It is noted that weak non-classical C-H…O plays the important and dominating roles in the formation of 2D supramolecular architectures of 1, but in 2 non-classical C-H…O and aromatic π…π Stacking interactions are quite important and play dominant roles in the self-assembly of 2D supramolecular architectures.
机构地区 College of Science
出处 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 2011年第11期1563-1568,共6页 结构化学(英文)
基金 Fund for Central Universities (ZXH2009D011) Natural Science Foundation of Tianjin (09JCYBJC04200) National Natural Science Foundation of China Civil Aviation Administration of China (61079010) Scientific Research Foundation of Civil Aviation University of China (2011KYS05)
关键词 3-(1H-imidazol-1-yi)-1-phenylpropan-1-one π…π stacking driving forces 3-(1H-imidazol-1-yi)-1-phenylpropan-1-one, π…π stacking, driving forces
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