In the solid-state structure of the title compound, C16H10FNO6, the configuration about the C=C double bond is E. The compound crystallized in the triclinic system, having space group P-1 with unit cell dimensions a = 5.829(10) ?, b = 8.801(16) ?, c = 13.543(3) ?, α = 87.753(15)°, β = 81.945(15)°, γ = 86.342(14)°. The structure of the molecule is V-shaped and in the crystal
the molecules are linked to form inversion dimers connected by pairs of C–H···O hydrogen bonds. 相似文献
Cadmium(II) complexes, dibromidobis(N,N′-dimethylthiourea-S)cadmium(II), [Cd(Dmtu)2Br2] (1) and diiodidobis(N,N′-dimethylthiourea-S)cadmium(II), [Cd(Dmtu)2I2] (2), have been prepared and their structures have been determined by X-ray crystal structure analysis. Compound 1 crystallized in the monoclinic space group C2/c, and the metal ion is situated on a twofold rotation axis. Compound 2 also crystallized in a monoclinic space group, P21/c, but here the molecules have no crystallographic symmetry. In both compounds the cadmium atom is bonded to two halide ions
and to two dimethylthiourea molecules through the sulfur atoms in a tetrahedral environment. The molecules are linked via
N–H⋯Halide hydrogen bonds to form infinite one-dimensional chains in 1 and infinite two dimensional networks in 2. The complexes were also characterized by IR and NMR spectroscopy and the data are consistent with the structures of the
compounds. 相似文献
Tributyltin(IV) derivatives of six different pharmaceutically active carboxylates were synthesized. The complexes were characterized by different analytical techniques (elemental analysis; infrared, NMR, and mass spectroscopy). 119Sn NMR data were also recorded in six different coordinating and non-coordinating solvents. The antibacterial activities of the compounds were tested using ten different bacteria relative to the reference drugs ampicillin and cephalexin. 相似文献
A number of palladium(II) complexes with Ph3P and aromatic amines as ligands having the general formula [(Ph3P)Pd(Ph3P)(NH2R)Cl2] {where R = Ph (1), m-ClC6H4(2), p-ClC6H5(3)} and [Pd(CH3NHPh)Cl2] (4), have been synthesized and characterized by elemental analysis, IR, 1H and 13C NMR. The X-ray crystal structure of [(Ph3P)Pd(m-ClC6H4NH2)Cl2] · CH2 Cl2(2) shows a distorted square planar environment around the Pd(II) ion with the P–Pd–N and Cl(1)–Pd–Cl(2) bond angles of 174.88(5)°
and 176.77(2)° respectively. The complexes were screened for enzyme inhibition activity against β-glucuronidase and found to be active. 相似文献
Two mono-nuclear axially distorted octahedral copper(II) complexes have been prepared and characterized via FT-IR, UV–Visible, elctrochemical, electron spin resonance and powder and single crystal XRD techniques. The complexes consist of a phenanthroline and two carboxylate ligands each bonded in bidentate fashion. Carboxylates are ortho-nitro-2-phenyl acetate (L1) and para-chloro-2-phenyl acetate (L2). Structural study showed that both complexes possess Jahn–Teller distorted octahedral geometry. The bulk purity was assessed from the matching experimental and simulated powder XRD spectra. The results of spectroscopic techniques are consistent with each other. ESR data revealed single electron occupancy of dx2 ? y2 orbital with 2B1g as ground state typical of tetragonally distorted octahedral geometry. Electrochemical solution study showed diffusion controlled electron transfer processes with diffusion co-efficient values of 10.323?×?10–8 cm2s–1 and 0.972?×?10–8 cm2s–1 for 1 and 2. Complexes exhibited excellent DNA-binding activity studied via UV–Visible spectroscopy, cyclic voltammetry, florescence spectroscopy and viscometry yielding Kb values of 1.871?×?104 M–1 (1) and 1.577?×?104 M–1 (2), 0.38?×?104 M–1 (1) and 6.39?×?104 M–1 (2) and 2.1?×?106 M–1 (1) and 2.0?×?06 M–1 (2), respectively, for the first three techniques. Complexes possess good antifungal activity against three fungal strains.
Novel azobenzene polyelectrolytes have been used to fabricate biocompatible self-assembled multilayer (SAMU) thin films of variable absorbance, thickness, organization, and morphology. The prepared SAMU films are useful for directed cell growth, and this application relies directly on control of contact and surface energy, and requires the ability to tune the surface characteristics which are critical to their development. The azo polyelectrolytes employed here were similar in their degree of polymerization and repeat unit composition of acrylic acid monomer and azo monomers, and only differ from each other due to the presence of different substituted head R-groups present on the p-position of the aromatic ring of the azo chromophores. Possession of characteristics of both the self-assembly due to acrylic acid groups, and photoswitchability of the azo monomer enable the azobenzene functionalized polyelectrolytes to exhibit novel photo-reversible applications. The azo polyelectrolytes with the substituted R-group pairs of shorter-ionized hydrophilic COOH and SO3H, shorter-non-ionized hydrophobic H and OC2H5, and larger-nonionized hydrophobic octyl C8H17 and C8F17 were used as polyanions and counter charge PDAC used as polycation to fabricate the layer-by-layer SAMU films onto glass and silicon substrates. The fabricated SAMU films were also characterized by various techniques. The UV absorption maxima, λmaxp of the SAMU films move to lower wavelength relative to solution to exhibit a blue shift for the hydrophobic R-groups, while this behaviour was not observed for the hydrophilic R-groups. Similarly, the thickness, organization, morphology and other properties of the thin films were found to be dependent on the type of substituted R-groups of the azo polyelectrolytes due to the inter-related factors of ionization, hydrophobicity/hydrophilicity, solubility, and aggregation of azo PEL in the dipping solutions used for fabrication of the SAMU films. Understanding and controlling the adsorption characteristics of azo multilayer thin–film of switchable functionalities are vital to explore their potential for the development and application of new devices in diverse areas of biosensor, drug delivery systems, on-chip microscale chemical process and microfluidics systems. 相似文献
This article reports the synthesis, characterization, geometrical optimization, and biological studies of new MBH-based organometallic compounds of medicinal significance. The ligand (MNHA) was prepared via the Morita–Baylis–Hillman (MBH) synthetic route, from aromatic aldehyde containing multiple functional groups. Metal complexes were prepared in an alkaline medium and under other suitable reaction conditions. Spectral and elemental analyses were used to identify the structural and molecular formulas of each compound. Optimized geometry was determined through density functional theory (DFT) B3LYP and 6-311++ G (d,p) basis set for the MBH adduct, whereas structures of novel complexes were optimized with the semi-empirical PM6 method. Powder XRD analysis furnished the crystal class of complexes, with Co3+, Cr3+, and Mn2+ being cubic, while Ni2+ was hexagonal, and Cu2+ was orthorhombic. Moreover, the ligand, along with Ni2+ and Co3+ complexes, showed profound antibacterial action against S. aureus, E. coli, B. pumilis, and S. typhi. Additionally, all of the complexes were shown to persist in the positive antioxidant potential of the ligand. Contrarily, not a single metal complex conserved the antifungal potentials of the ligand. 相似文献