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Журнал структурной химии/2013/№ 5/
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CRYSTAL STRUCTURES OF AZIDO OR THIOCYANATO-COORDINATED NICKEL(II) COMPLEXES WITH TRIDENTATE SCHIFF BASES

A new azido-coordinated nickel(II) complex [NiL1(N3)] (1) and a new thiocyanato-coordinated nickel(II) complex [NiL2(NCS)] (2), where L1 and L2 are the monoanionic forms of Schiff bases 2-[(2-isopropylaminoethylimino)methyl]-6-methylphenol and 2-[(2-dimethlaminoethylimino)methyl]-6-methylphenol respectively, are prepared and structurally characterized by elemental analysis, IR spectra, and single crystal X-ray crystallography. Complex 1 crystallizes in the triclinic space group P-1 with unit cell dimensions a = 8.812(2) ?, b = 9.433(3) ?, c = 9.488(2) ?, a = 81.933(2)°, b = 69.925(2)°, g = 84.591(2)°, V = 732.5(3) ?3, Z = 2, R1 = 0.0291, and wR2 = 0.0734. Complex 2 crystallizes in the monoclinic space group P21/n with unit cell dimensions a = 7.4497(4) ?, b= 6.1933(3) ?, c = 31.5126(18) ?, b = 92.484(2)°, V = 1452.57(13) ?3, Z = 4, R1 = 0.0307, and wR2 = 0.0668. The Ni atom in each of the complexes is coordinated by three donor atoms of the Schiff base ligand and by one N atom of the azide or thiocyanate ligand, forming a square planar geometry. The azide and thiocyanate anions readily coordinate to the complexes as secondary ligands.

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The Ni atom in each of the complexes is coordinated by three donor atoms of the Schiff base ligand and by one N atom of the azide or thiocyanate ligand, forming a square planar geometry. <...> The azide and thiocyanate anions readily coordinate to the complexes as secondary ligands. <...> INTRODUCTION The Schiff bases derived from salicylaldehyde and its derivatives are a kind of versatile ligands in coordination chemistry [ 1—3 ]. <...> The search in the Cambridge Crystallographic Database (CSD; version 5.32 with addenda up to February 2012) [ 15 ] has revealed that no complexes derived from 2-[(2-isopropylaminoethylimino)methyl]-6-methylphenol (HL1; Scheme 1) and 2-[(2-dimethlaminoethylimino)methyl]-6methylphenol (HL2; Scheme 1) have been reported, and even very few complexes have been reported based on the Schiff bases derived from 3-methylsalicylaldehyde. <...> Single crystal structural X-ray diffraction was carried out on a Bruker X8 PROTEUM diffractometer. <...> Diffraction intensities for the complexes were collected at 298(2) K using a Bruker X8 PROTEUM diffractometer with MoKh radiation (y = 0.71073 Е). <...> All of the non-hydrogen atoms were refined anisotropically. <...> Single crystal X-ray diffraction shows that the complexes crystallize as similar azido- or thiocyanato-coordinated mononuclear structures (Fig. 1 for 1, Fig. 2 for 2). <...> The Ni atom in each of the complexes is in a square planar coordination environment and is four-coordinated by one phenolate O and two N atoms of the Schiff base ligand and by one N atom of a pseudohalide ligand (azide for 1 and thiocyanate for 2). <...> A slight distortion of the square planar coordination is revealed by the bond angles. <...> A new azido-coordinated nickel(II) complex [NiL1(N3)] (1) and a new thiocyanato-coordinated nickel(II) complex [NiL2(NCS)] (2), where L1 and L2 are the monoanionic forms of Schiff bases 2-[(2-isopropylaminoethylimino)methyl]-6-methylphenol and 2-[(2-dimethlaminoethylimino)methyl]-6-methylphenol respectively, are prepared and structurally characterized by elemental analysis, IR spectra, and single crystal X-ray crystallography. <...> The Ni atom in each of the complexes is coordinated by three donor atoms of the Schiff base ligand and by one N atom of the azide or thiocyanate ligand, forming a square planar geometry. <...> The azide and thiocyanate anions readily coordinate to the complexes as secondary ligands.. <...>
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