


Том 42, № 6 (2016)
- Год: 2016
- Статей: 9
- URL: https://bakhtiniada.ru/1070-3284/issue/view/13286
Article
Coordination silver polymer with the bridging anion of oxadiazolylacrylic acid: Synthesis, crystal structure, and luminescence properties
Аннотация
Metal complex [AgL] (I) is synthesized by the reaction of AgNO3 with 3-(5-furyl-1,3,4-oxadiazol-2-yl)acrylic acid (HL, C9H6N2O4), and its crystal structure is determined (CIF file CCDC no. 1426528). The crystals are monoclinic, space group P21/n, a = 4.946(1), b = 20.084(1), c = 9.015(1) Å, β = 92.32(1)°, V = 894.482 Å3, ρcalcd = 2.442 g/cm3, Z = 4. In structure I, pairs of centrosymmetric silver atoms are bound by bidentate-bridging oxygen atoms of two anions L into dimeric blocks. The Ag–Ag distance in the dimer is 2.854(1) Å. The coordination sphere of Ag+ contains two oxygen atoms, one silver atom, and one nitrogen atom of the diazolyl fragment of the adjacent anion. The coordination polyhedron of Ag+ is a strongly distorted tetrahedron. The molecular packing of crystal I is built of infinite ribbons (AgL)n extended along the direction [001]. The photoluminescence spectrum of compound I contains intense bands about 550 nm corresponding to the green spectral range and less intense bands at 425 and 485 nm.



The novel dinuclear complex tetraaquahexakis(nitrato-O,O')bis(2,4,6,8-tetramethyl-2,4,6,8-tetraazabicyclo[3.3.0]octane-3,7-dione-O,O')dipraseodymium(III): Synthesis and crystal structure
Аннотация
A centrosymmetric dinuclear complex, [Pr(C8H14N4O2)(H2O)2(NO3)3]2 (I), was obtained from praseodymium(III) nitrate and the bicyclic bisurea 2,4,6,8-tetramethyl-2,4,6,8-tetraazabicy-clo[ 3.3.0]octane-3,7-dione (mebicar, Mc) and structurally characterized (CIF file CCDC no. 1435137). The crystals of complex I are triclinic: space group \(P\bar 1\), a = 9.8967(5), b = 10.3689(5), c = 11.0018(6) Å, α = 74.650(5)°, β = 68.064(5)°, γ = 67.257(5)°, V = 956.22(10) Å3, ρcalcd = 1.949 g/cm3, Z = 1. The praseodymium atom is coordinated to two O atoms of two Mc molecules (related by a center of symmetry), three bidentate nitrate anions, and two water molecules. So its coordination polyhedron has ten vertices; the Pr…Pr distance is 9.8726(7) Å.



Copper(I) complexes with phenylphosphonous acid diamide
Аннотация
Copper(I) halide complexes with phenylphosphonous diamide ligand (L), C56H100Br4Cu4N8P4 (II) and C56H100Cu4I4N8P4 (III), were synthesized and studied by X-ray diffraction to determine their molecular and crystal structures (CIF files CCDC nos. 1426622 (II), 1426623 (III)). The prepared coordination compounds are cubane-like tetramers like L4Cu4X4. During the reaction, copper(I) is coordinated to the phosphorus atom of ligand L. The stability of the complexes depends considerably on the halogen atom. The iodide complexes are most stable during storage.



Anion-assisted two group IIB metallic coordination architecture and luminescence performance
Аннотация
React of cadmium salts with 4,4'-bis((2-(pyridin-2-yl)-1H-benzo[d]imidazol-1-yl)methyl)biphenyl (Bpbib) yields two one-dimensional (1D) coordination architectures of two new complexes—{[Cd2(Bpbib)2(NO3)4] • CH3OH}n (I) and {[Cd(Bpbib)Cl2] • 2CH3OH}n (II). Complexes I and II were characterized by the elemental analyses, photoluminescence and emission spectra and single-crystal X-ray diffraction (CIF files CCDC nos. 1046021 (I), 1046022 (II)). Complex I is a helical array, whereas II features a zigzag pattern, depending upon the type of their associated anions. In addition to the primary organic linker, the counter anions also have a dominant influence on the overall structures, and even arouse the luminescence performance diversity.



New Ni(II) and Co(II) coordination compounds construction from the ditopic 1,2,3-triazol-based aromatic heterocyclic polycarboxylic ligand
Аннотация
Mononuclear compound I ([Co(Ptia)2(H2O)4] • H2O) and 1D chain compound II ([Ni4(Cptia)4(H2O)12]∞) have been constructed from the new ditopic 1,2,3-trazol-based aromatic heterocyclic carboxylic ligand, 4-(4-carboxy-1H-1,2,3-triazol-1-yl) benzoic acid) (H2Cptia), under different pH conditions by using the hydrothermal method. Their structure was characterized by single crystal X-ray diffraction (СIF files CCDC nos. 1409531 (I) and 1409531 (II)), IR spectra, and elemental analysis. Compound I is a mononuclear compound. In II, two sets of parallel arrangement 1D chains orient in different directions. The results of their magnetic measurements display the antiferromagnetic interaction exists among the paramagnetic ions.



Experimental and computational studies of [N'-(2-hydroxy-3-methoxybenzylidene)-4-methylbenzenesulfonohydrazide]nickel(II)
Аннотация
Mononuclear Ni(II) complex (C30H30NiN4O8S2) (I) has been obtained with 1: 2 metal/ligand ratio and characterized by single crystal X-ray diffraction (CIF file CCDC no. 1040830), IR, UV-Vis spectroscopic techniques and DFT. X-ray results show that complex I crystallizes in the monoclinic system, space group P21/n with four molecules in the unit cell. In structure I, the coordination around Ni atom is distorted square planar. In addition to the crystal structure, the molecular geometry, vibrational frequencies, molecular electrostatic potential, and frontier molecular orbital analysis of compound I in the ground state have been calculated using the B3LYP/6-311G and B3LYP/3-21G methods. The computed vibrational frequencies are used to determine the types of molecular motions associated with each of the observed experimental bands.



Synthesis, characterization, crystal structures, and antimicrobial activity of cobalt(II) and iron(III) complexes derived from N'-(2-hydroxybenzylidene)-3-methylbenzohydrazide
Аннотация
A new cobalt(II,III) complex, [CoIIIL2]2[Co2II(HL)2(OH2)2(CH3OH)2] • 2H2O (I) and a new iron(III) complex, [FeIII(HL)2](NO3) (II), where L2– and HL– are the dianionic and monoanionic form of N'-(2-hydroxybenzylidene)-3-methylbenzohydrazide, respectively, have been prepared and characterized by elemental analyses, infrared and UV-Vis spectroscopy and single-cyrstal X-ray diffraction (CIF files CCDC nos. 1417971 (I), 1417979 (II)). Complex I crystallizes in the monoclinic space group P21/n with unit cell dimensions a = 16.1665(9), b = 14.5692(8), c = 19.086(1) Å, β = 96.347(1)°, V = 4467.9(4) Å3, Z = 2, R1 = 0.0521, and wR2 = 0.1411. Complex II crystallizes in the orthorhombic space group Pbcn with unit cell dimensions a = 12.475(1), b = 12.202(1), c = 18.859(2) Å, V = 2870.8(4) Å3, Z = 4, R1 = 0.0796, and wR2 = 0.1981. The metal atoms in the complexes are in octahedral coordination. Crystals of the complexes are stabilized by hydrogen bonds. The efficiency of the aroylhydrazone and the two complexes was evaluated against B. subtilis, S. aureus, E. coli, P. fluorescence, C. albicans and A. niger, with the complexes demonstrating enhanced activity relatively to the free ligand.



Syntheses, crystal structures, and properties of two supramolecules based on methoxyphenyl imidazole dicarboxylates
Аннотация
Two cobalt(II) and cadmium(II) complexes, [Co(H2DMOPhIDC)2(H2O)2] • 2H2O (H3DMOPhIDC = 2-(3,4-dimethoxyphenyl)-1H-imidazole-4,5-dicarboxylic acid) (I), [Cd(H2MOPhIDC)2-(Phen)] • C2H5OH (H3MOPhIDC = 2-(3-dimethoxyphenyl)-1H-imidazole-4,5-dicarboxylic acid, Phen = 1,10-phenanthroline) (II), have been hydro(solvo)thermally synthesized by employing two kinds of organic ligands, H3DMOPhIDC or H3MOPhIDC, respectively. The molecular structures of I and II have been characterized by IR spectra, elemental analyses and single-crystal X-ray diffraction (CIF files CCDC nos. 935845 (I), 935846 (II)). Both complexes show three-dimensional supramolecular structures supported by intermolecular H-bonds. Furthermore, the thermogravimetric and photoluminescent properties of two complexes have been investigated as well.



Synthesis, crystal structures, and antimicrobial activity of copper(II) and zinc(II) complexes derived from 2-bromo-4-chloro-6-[(2-morpholin-4-ylethylimino)methyl]phenol
Аннотация
An end-to-end azido-bridged dinuclear copper(II) complex [Cu2L2(μ1,3-N3)](NO3) (I) and a mononuclear zinc(II) complex [ZnCl2(HL)] • CH3OH (II), where L is 2-brom-4-chloro-6-[(2-morpholin- 4-ylethylimino)methyl]phenolate, have been prepared and characterized by elemental analyses, IR, and single crystal X-ray crystallographic determination (CIF files CCDC nos. 1415217 (I), 1415218 for (II)). The crystal of I is monoclinic: space group C2/c, a = 28.684(2), b = 7.1787(5), c = 18.292(1) Å, β = 117.887(3)°, V = 3329.1(4) Å3, Z = 4. The crystal of II is monoclinic: space group P21/c, a = 10.8207(9), b = 12.3398(7), c = 14.9477(7) Å, β = 93.473(3)°, V = 1992.2(2) Å3, Z = 4. The Schiff base ligand in I coordinates to the Cu atom through the phenolate O, imine N, and morpholine N atoms, while the Schiff base ligand in II coordinates to the Zn atom through the phenolate O and imine N atoms, with the morpholine N atom protonated. The effect of these complexes on the antimicrobial activity against Staphylococcus aureus, Escherichia coli, and Candida albicans was studied.


