Synthesis, Characterization and Crystal Structure of a Noncentrosymmetric Coordination Polymer with

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Hydrothermal reaction of 3-aminopyridine, NaSCN and cadmium cation led to the formation of complex [Cd(3-ampy)(NCS)2]n 1 (3-aminopyridine = 3-ampy), and its crystal structure was determined by X-ray diffraction analysis. The crystal data for compound 1: C7H6N4S2Cd, orthorhombic Fdd2, Mr = 322.68, Z = 16, a = 26.884(4), b = 27.445(3), c = 5.8671(7)(A), V = 4329.0(10)(A)3, Dc = 1.974 g/cm3, μ = 2.368 mm-1, F(000) = 2496, R = 0.0203 and wR = 0.0491 for 2347 observed reflections with I > 2σ(I), and absolute structure parameter is 0.00(3). X-ray diffraction reveals that the compound consists of interesting two-dimensional wave sheet structure. The photoluminescence spectrum and interesting second-order nonlinear optical (NLO) property for compound 1 have also been studied.
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