三维混合价态铜配位聚合物[Cu(Me_2dtc)_2(CuI)_3]_n的合成与晶体结构(英文)

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A new three-dimensional copper dithiocarbamate-copper iodide coordination polymer [Cu(Me2dtc)2(CuI)3]n (Me2dtc=N,N-dimethyldithiocarbamate) was synthesized by reactions of Cu(OAc)2,NaI and Na(Me2dtc) in DMF solution,characterized by elemental analysis,IR spectrum,and single-crystal X-ray diffraction. The crystal belongs to the monoclinic system,space group C2/c with a=1.293 89(17) nm,b=1.077 61(11) nm,c=1.456 05(17) nm,β=115.585 (4)°,V=1.831 1 (4) nm3,Z=4,Dc=3.175 g·cm-3,Mr=875.28,λ (Mo Kα)=0.071 073 nm,μ=10.082 mm-1,F(000)=1 604,the final R=0.029 5 and wR=0.081 7. A total of 2 083 unique reflections were collected,of which 1 918 with I>2σ(I) were observed. The Cu atoms are Cu(Ⅰ)/Cu(Ⅱ) mixed-valence and they have two different coordinate geometries,namely planar square and tetrahedron. This three-dimensional structure consists of individual Cu(Me2dtc)2 molecules linking together CuI polymeric chains which run parallel to the [001] direction vis Cu-S bonds. A new three-dimensional copper dithiocarbamate-copper iodide coordination polymer [Cu (Me2dtc) 2 (CuI) 3] n (Me2dtc = N, N-dimethyldithiocarbamate) was synthesized by reactions of Cu (OAc) 2, NaI and Na (Me2dtc) in DMF solution, characterized by elemental analysis, IR spectrum, and single-crystal X-ray diffraction. The crystal belongs to the monoclinic system, space group C2 / c with a = 1.293 89 (17) nm, ), c = 1.456 05 (17) nm, β = 115.585 (4) °, V = 1.831 1 (4) nm3, Z = 4, Dc = 3.175 g · cm-3, Mr = 875.28, λ = 0.071 073 nm, μ = 10.082 mm-1, F (000) = 1 604, the final R = 0.029 5 and wR = 0.081 7. A total of 2 083 unique reflections were collected, of which 1 918 with I> The Cu atoms are Cu (I) / Cu (II) mixed-valence and they have two different coordinate geometries, are planar squares and tetrahedron. This three-dimensional structure consists of individual Cu (Me2dtc) 2 molecules linking together CuI polymeric chains which run parallel to the [001] direction vis Cu-S bonds.
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