RIQUIM - Repositorio Institucional de la Facultad de Química - UdelaR

Comparative ab initio and semi-empirical study of hydrogen bonded complexes of NH3 and H2O

Tags: Complejos, Hydrógeno

The crystal structure and magnetic properties of 3-pyridinecarboxylate-bridged Re(ii)M(ii) complexes (M = Cu, Ni, Co and Mn)

Tags: Cobre, Complejos, Química Inorgánica

Relative affinity of bambus[6]uril towards halide ions : A DFT/GIAO approach in the gas phase, and in the presence of the solvent employing discrete and discrete-continuum models

Tags: Complejos, Química supramolecular

Ab initio Study of the Structure of Radical Cations Derived from H-Bonded Complexes : A Comparison between [H2CO.H2O]+ and [H2CO.HF]+.

Tags: Cationes radicales, Complejos

Ir-Spectra of Some Cobalt (II) Complexes Containing Imidazole.

Tags: Cobalto III, Complejos, Imidazol

High Level Ab Initio Prediction of the Structure and IR Spectra of Formaldehyde-Water Radical-Cation Complexes.

Tags: Complejos, Espectrocospía infrarrojo, Formaldehído

Preparation of Tc-99m-Thiourea Complex as a Precursor for Tc(III)Labeled Compound.

Tags: Complejos, Tecnecio, Tiourea

Synthesis : Characterization and Potentiometric Studies of Trans-Dioxorhenium(V) Complexes-X-Ray Crystal-Structure of (Reo2(TN)(2))I-Center-Dot-H2O.

Tags: Caracterizacion, Complejos

Transition structure and reactive complexes for hydride transfer in an isoalloxazine-nicotinamide complex. On the catalytic mechanism of glutathione reductase. An ab initio MO SCF study.

Tags: Complejos, Glutationa reductasa

Base Hydrolysis and Aquation of Trans-Methyl-Substituted Acidopenta-Amminecobalt(III) Complexes.

Tags: Cobalto, Complejos, Estereoquimica, Hidrólisis

Kinetic Study of the Substitution of [Tc(tu)6]3+ by Polyaminocarboxylic Acids.

Tags: Ácidos policarboxílicos, Complejos, Estudios cinéticos, Tecnecio, Tiourea

Structural and Conformational-Analysis of Tc-V and Re-V Dioxo Complexes-X-Ray Cristal-Structure of (Tco2(TN)(2))I-Center-Dot-H2O.

Tags: Complejos, Estructura, Química Inorgánica, Renio, Tecnecio

Synthesis : Characterization and Crystal-Structure of Hexakis-(Thiourea-S) Rhenium (III)Trichloride Tetrahydrate- A Potential Precursor to Low-Valent Rhenium Complexes.

Tags: Complejos, Estructura, Renio, Tiourea

Molecular dynamics Simulation of a Zif268-DNA Complex in Water. Spatial Patterns and Fluctuations Sensed from a Nanosecond Trajector.

Tags: Aguas, Complejos

DNA structure and fluctuations sensed from a 1.1ns molecular dynamics trajectory of a fully charged Zif268-DNA complex in water.

Tags: Agua, Complejos

Preparation and Chemical Studies on Tc (III) Complexes Containing Polyaminocarboxylic Acid.

Tags: Ácidos poliaminocarboxilicos, Complejos, Tecnecio

Crystal structure and spectroscopic behaviour of a binuclear copper (II) complex of flufenamic acid and dimethylformamide.

Tags: Cobre, Complejos, Estructura cristalina

Crystal structure and spectroscopic behaviour of a binuclear copper (II) complex of mefenamic acid and dimethylsulfoxide.

Tags: Cobre, Complejos, Estructura cristalina

Infrared spectra of the copper (II) complexes of amino acids with hydroxylic residues.

Tags: Aminoácidos, Cobre, Complejos, Espectroscopía de infrarojo

Solubility and lipophilicity tests of copper (II) complexes of the essential aminoacids.

Tags: Cobre, Complejos

Spontaneous and base catalyzed nitrito to nitro linkage isomerization of trans-[Co(NH)3)4(NH2CH3)ONO]2+complex.

Tags: Complejos, Química orgánica

Competition study for the base hydrolysis of trans-[Co(NH3)4(NH2CH3)X]n+complexes.

Tags: Complejos, Hidrólisis, Química Inorgánica

Copper (II) complexes with several sulfonamides : synthesis.

Tags: Antiinfecciosos, Cobre, Complejos

Tris(1,10-phenanthroline) nickel(II)dinitrate thiourea monohydrate.

Tags: Complejos, Estructura cristalina, Fenantrolina, Nitratos, Tiourea

[Co(phen)(thiourea)(H2O)Cl2]-thiourea(phen is 1,10-phenanthroline).

Tags: Cobre, Complejos, Estructura cristalina, Tiourea

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Prostaglandinas : desde el punto de vista farmacológico (analgésicos) : modo de acción, efectos, contraindicaciones, reacciones adversas, síntesis, farmacocinética

Comparative ab initio and semi-empirical study of hydrogen bonded complexes of NH3 and H2O

The crystal structure and magnetic properties of 3-pyridinecarboxylate-bridged Re(ii)M(ii) complexes (M = Cu, Ni, Co and Mn)

Relative affinity of bambus[6]uril towards halide ions : A DFT/GIAO approach in the gas phase, and in the presence of the solvent employing discrete and discrete-continuum models

Ab initio Study of the Structure of Radical Cations Derived from H-Bonded Complexes : A Comparison between [H2CO.H2O]+ and [H2CO.HF]+.

Ir-Spectra of Some Cobalt (II) Complexes Containing Imidazole.

High Level Ab Initio Prediction of the Structure and IR Spectra of Formaldehyde-Water Radical-Cation Complexes.

Preparation of Tc-99m-Thiourea Complex as a Precursor for Tc(III)Labeled Compound.

Synthesis : Characterization and Potentiometric Studies of Trans-Dioxorhenium(V) Complexes-X-Ray Crystal-Structure of (Reo2(TN)(2))I-Center-Dot-H2O.

Transition structure and reactive complexes for hydride transfer in an isoalloxazine-nicotinamide complex. On the catalytic mechanism of glutathione reductase. An ab initio MO SCF study.

Base Hydrolysis and Aquation of Trans-Methyl-Substituted Acidopenta-Amminecobalt(III) Complexes.

Kinetic Study of the Substitution of [Tc(tu)6]3+ by Polyaminocarboxylic Acids.

Structural and Conformational-Analysis of Tc-V and Re-V Dioxo Complexes-X-Ray Cristal-Structure of (Tco2(TN)(2))I-Center-Dot-H2O.

Synthesis : Characterization and Crystal-Structure of Hexakis-(Thiourea-S) Rhenium (III)Trichloride Tetrahydrate- A Potential Precursor to Low-Valent Rhenium Complexes.

Molecular dynamics Simulation of a Zif268-DNA Complex in Water. Spatial Patterns and Fluctuations Sensed from a Nanosecond Trajector.

DNA structure and fluctuations sensed from a 1.1ns molecular dynamics trajectory of a fully charged Zif268-DNA complex in water.

Preparation and Chemical Studies on Tc (III) Complexes Containing Polyaminocarboxylic Acid.

Crystal structure and spectroscopic behaviour of a binuclear copper (II) complex of flufenamic acid and dimethylformamide.

Crystal structure and spectroscopic behaviour of a binuclear copper (II) complex of mefenamic acid and dimethylsulfoxide.

Infrared spectra of the copper (II) complexes of amino acids with hydroxylic residues.

Solubility and lipophilicity tests of copper (II) complexes of the essential aminoacids.

Spontaneous and base catalyzed nitrito to nitro linkage isomerization of trans-[Co(NH)3)4(NH2CH3)ONO]2+complex.

Competition study for the base hydrolysis of trans-[Co(NH3)4(NH2CH3)X]n+complexes.

Copper (II) complexes with several sulfonamides : synthesis.

Tris(1,10-phenanthroline) nickel(II)dinitrate thiourea monohydrate.

[Co(phen)(thiourea)(H2O)Cl2]-thiourea(phen is 1,10-phenanthroline).