2014•Functional Materials LettersRequires access

Synthesis, structure and electrochemical behavior of a 3D crystalline copper(II) metal-organic framework

Hong‐Ye Bai, Weiqiang Fan, Chun‐Bo Liu, Weidong Shi, Yongsheng Yan

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Abstract

Using an flexible amide-type tripodal ligand N , N ′, N ″-tris(3-pyridyl)-1,3,5-benzenetricarboxamide (L) and 1,4-benzenedicarboxylic acid ( H 2 bdc ), a three-dimensional copper(II) metal-organic framework (MOF) formulated as [ Cu ( bdc )( L )]n has been hydrothermally synthesized and structurally characterized by IR, elemental, X-ray single-crystal diffraction and thermal analysis. The complex crystallizes in the triclinic, space group P - 1, a = 8.891(2) Å, b = 11.760(2) Å, c = 15.348(3) Å, α = 96.73(3)°, β = 105.96(3)°, γ = 106.47(3)°, V = 1446.2(5) Å3, Mr = 666.10, Dc = 1.530 g/cm3, Z = 2, F(000) = 682, GOOF = 1.0560, μ(MoKα) = 0.817 mm-1, R = 0.0366 and wR = 0.0885. The structural analyses reveal that the title compound consists of one Cu ( II ) atom, two halves of bdc, and one L ligand. Each Cu ( II ) atom is linked by two bdc ligands and three L ligands to form a three-dimensional network. In addition, the electrochemical behavior of title compound has been studied. CCDC No. 990526.

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Using an flexible amide-type tripodal ligand N , N ′, N ″-tris(3-pyridyl)-1,3,5-benzenetricarboxamide (L) and 1,4-benzenedicarboxylic acid ( H 2 bdc ), a three-dimensional copper(II) metal-organic framework (MOF) formulated as [ Cu ( bdc )( L )]n has been hydrothermally synthesized and structurally characterized by IR, elemental, X-ray single-crystal diffraction and thermal analysis. The complex crystallizes in the triclinic, space group P - 1, a = 8.891(2) Å, b = 11.760(2) Å, c = 15.348(3) Å, α = 96.73(3)°, β = 105.96(3)°, γ = 106.47(3)°, V = 1446.2(5) Å3, Mr = 666.10, Dc = 1.530 g/cm3, Z = 2, F(000) = 682, GOOF = 1.0560, μ(MoKα) = 0.817 mm-1, R = 0.0366 and wR = 0.0885. The structural analyses reveal that the title compound consists of one Cu ( II ) atom, two halves of bdc, and one L ligand. Each Cu ( II ) atom is linked by two bdc ligands and three L ligands to form a three-dimensional network. In addition, the electrochemical behavior of title compound has been studied. CCDC No. 990526.

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Available abstract

Using an flexible amide-type tripodal ligand N , N ′, N ″-tris(3-pyridyl)-1,3,5-benzenetricarboxamide (L) and 1,4-benzenedicarboxylic acid ( H 2 bdc ), a three-dimensional copper(II) metal-organic framework (MOF) formulated as [ Cu ( bdc )( L )]n has been hydrothermally synthesized and structurally characterized by IR, elemental, X-ray single-crystal diffraction and thermal analysis. The complex crystallizes in the triclinic, space group P - 1, a = 8.891(2) Å, b = 11.760(2) Å, c = 15.348(3) Å, α = 96.73(3)°, β = 105.96(3)°, γ = 106.47(3)°, V = 1446.2(5) Å3, Mr = 666.10, Dc = 1.530 g/cm3, Z = 2, F(000) = 682, GOOF = 1.0560, μ(MoKα) = 0.817 mm-1, R = 0.0366 and wR = 0.0885. The structural analyses reveal that the title compound consists of one Cu ( II ) atom, two halves of bdc, and one L ligand. Each Cu ( II ) atom is linked by two bdc ligands and three L ligands to form a three-dimensional network. In addition, the electrochemical behavior of title compound has been studied. CCDC No. 990526.

Key concepts: Triclinic crystal system, Crystallography, Copper, Ligand (biochemistry), Amide, Electrochemistry, Crystal structure, Metal

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