Synthesis, Structure, and the Second-order Nonlinear Optical Properties of a Borate-carboxylic Acid Compound: KB[L-(-)-C4H4O5]2·H2O
杨坤;杨明;雍胜利;张骁勇;罗军华
a (Teachers College, Inner Mongolia University of Science and Technology, Baotou 014030, China)
b (State Key Laboratory of Structural Chemistry, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou 350002, China)
Synthesis, Structure, and the Second-order Nonlinear Optical Properties of a Borate-carboxylic Acid Compound: KB[L-(-)-C4H4O5]2·H2O
YANG Kun;YANG Ming;YONG Sheng-Li;ZHANG Xiao-Yong;LUO Jun-Hua
a (Teachers College, Inner Mongolia University of Science and Technology, Baotou 014030, China)
b (State Key Laboratory of Structural Chemistry, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou 350002, China)
A new organic-inorganic hybrid noncentrosymmetric potassium bis(malic acid)- borates KB(L-(-)-C4H4O5)2·H2O was synthesized by solution method. It was characterized by elemental analysis, FT-IR, TGA and single-crystal X-ray crystallography. It crystallizes in the monoclinic space group P21/c with a = 5.546(6), b = 11.985(13), c = 9.952(11) Å, β = 97.522(17)°, V = 655.8(13) Å3, Z = 2, Dc = 1.682 g/cm3, μ(MoKa) = 0.46 mm–1 and F(000) = 340. 5009 reflections were measured and 2893 independent reflections (Rint = 0.051) were used for further refinement. Single-crystal X-ray diffraction reveals that the complex exhibits a three- dimensional pseudo tunnel structure consisting of fundamental building block [B(L-(-)- C4H4O5)2]– anions. The small cavities are occupied by the H2O molecules, which stabilize the whole structure by O–H...O hydrogen bonds. The complex exhibits nonlinear optical effect as high as 1.5 times that of KDP standard.
A new organic-inorganic hybrid noncentrosymmetric potassium bis(malic acid)- borates KB(L-(-)-C4H4O5)2·H2O was synthesized by solution method. It was characterized by elemental analysis, FT-IR, TGA and single-crystal X-ray crystallography. It crystallizes in the monoclinic space group P21/c with a = 5.546(6), b = 11.985(13), c = 9.952(11) Å, β = 97.522(17)°, V = 655.8(13) Å3, Z = 2, Dc = 1.682 g/cm3, μ(MoKa) = 0.46 mm–1 and F(000) = 340. 5009 reflections were measured and 2893 independent reflections (Rint = 0.051) were used for further refinement. Single-crystal X-ray diffraction reveals that the complex exhibits a three- dimensional pseudo tunnel structure consisting of fundamental building block [B(L-(-)- C4H4O5)2]– anions. The small cavities are occupied by the H2O molecules, which stabilize the whole structure by O–H...O hydrogen bonds. The complex exhibits nonlinear optical effect as high as 1.5 times that of KDP standard.
This work was supported by the National Natural Science Foundation of China (No. 51563019) and the Natural Science Foundation of Inner Mongolia (No. 2013MS0212, 2018BS02009)
杨坤;杨明;雍胜利;张骁勇;罗军华. Synthesis, Structure, and the Second-order Nonlinear Optical Properties of a Borate-carboxylic Acid Compound: KB[L-(-)-C4H4O5]2·H2O[J]. 结构化学, 2019, 38(8): 1398-1403.
YANG Kun;YANG Ming;YONG Sheng-Li;ZHANG Xiao-Yong;LUO Jun-Hua. Synthesis, Structure, and the Second-order Nonlinear Optical Properties of a Borate-carboxylic Acid Compound: KB[L-(-)-C4H4O5]2·H2O. CHINESE JOURNAL OF STRUCTURAL CHEMISTRY, 2019, 38(8): 1398-1403.
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2019, Vol. 38 
