Search results for "square"

showing 10 items of 1317 documents

Coordinative versatility of the carbonic anhydrase inhibitor benzolamide in zinc and copper model compounds

1999

New benzolamide (H 2 bz, 5-phenylsulfonamide-1,3,4-thiadiazole-2-sulfonamide) zinc(II) and copper(II) complexes with tris(2-benzimidazolyl-methylamine) (L) and ammonia are reported. The crystal structures of the Zn(II) complexes were determined. The [Zn(Hbz)L]ClO 4 · H 2 O compound crystallizes in the triclinic space group with a =11.006(1), b =14.777(2), c =14.918(2) A, α =114.30(1), β =98.90(1), γ =107.36(1)° and Z =2. In this compound the Zn(II) has a distorted trigonal bipyramidal geometry. The {[Zn 2 (bz) 2 (NH 3 ) 4 ] · 2H 2 O} ∞ crystallizes in the monoclinic space group C 2/ c with a =23.530(3), b =10.4124(11), c =15.428(2) A, β =110.591(9)° and Z =4. The metal centre is in a distor…

DenticityStereochemistrychemistry.chemical_elementZincCrystal structureTriclinic crystal systemBiochemistryCopperSquare pyramidal molecular geometryInorganic ChemistryTrigonal bipyramidal molecular geometryCrystallographyDeprotonationchemistryJournal of Inorganic Biochemistry
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Countercomplementarity and Strong Ferromagnetic Coupling in a Linear Mixed μ-Acetato, μ-Hydroxo Trinuclear Copper(II) Complex. Synthesis, Structure, …

2001

The structural and magnetic data of the trinuclear compound [Cu3(L)2(CH3COO)2(OH)2(dmf)2] (HL = N-(2-methylpyridyl)toluensulfonylamide) are reported. The compound crystallizes in the monoclinic system, space group P2(1)/n (no. 14), with a = 11.6482(6) A, b = 13.5772(6) A, c = 13.5306(7) A, alpha = 90 degrees, beta = 92.859(5) degrees, gamma = 90 degrees, and Z = 2. The three copper atoms form an exact linear arrangement. Neighboring coppers are connected by a hydroxo bridge and a bidentate syn-syn carboxylato group. The coordination spheres of the terminal copper atoms are square pyramidal with a dmf molecule as the apical ligand. The central copper has a regular square planar geometry. The…

Denticitychemistry.chemical_elementDihedral angleCopperSquare pyramidal molecular geometrylaw.inventionInorganic ChemistryCrystallographychemistrylawMoleculeMoietyPhysical and Theoretical ChemistryElectron paramagnetic resonanceMonoclinic crystal systemInorganic Chemistry
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Crystal structures and magnetic properties of the squarate-O1,On-bridged dinuclear copper(II) complexes [Cu2(phen)4(C4O4)](CF3SO3)2 · 3H2O (n=2) and …

1999

Abstract Two dinuclear copper(II) complexes of the formula [Cu2(phen)4(C4O4)](CF3SO3)2 · 3H2O (1) and [Cu2(bipy)4(C4O4)](CF3SO3)2 · 6H2O (2) [phen=1,10-phenanthroline, bipy=2,2′-bipyridine and C4O4 2−=dianion of 3,4-dihydroxy-3-cyclobuten-1,2-dione (squaric acid)] have been synthesized and characterized by single-crystal X-ray diffraction. Their structures consist of [Cu2(phen)4(C4O4)]2+ (1) and [Cu2(bipy)4(C4O4)]2+ (2) dinuclear copper(II) cations, uncoordinated CF3SO3 − anions and crystallization water molecules. The copper is in a distorted square pyramidal environment: one squarate-oxygen atom and three phen- (1) or bipy- (2) nitrogen atoms of two phen (1) or bipy (2) terminal ligands f…

Denticitychemistry.chemical_elementSquaric acidCrystal structureCopperMagnetic susceptibilitySquare pyramidal molecular geometryInorganic Chemistrychemistry.chemical_compoundCrystallographychemistryIntramolecular forceMaterials ChemistryMoleculePhysical and Theoretical ChemistryInorganica Chimica Acta
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Preparation and structural studies on the tBu2Sn(IV) complexes with aromatic mono- and dicarboxylic acids containing hetero {N} donor atom

2004

Nine complexes of 'Bu2Sn(IV)(2+) were obtained in the solid state with ligands containing -COOH group(s) and aromatic (N) donor atom. The binding sites of the ligands were identified by FT-IR spectroscopic measurements. It was found that in most cases the -COO- groups are co-ordinated in monodentate manner. Nevertheless, in some of our complexes, the -COO- group forms bridges between two central {Sn} atoms resulting in the formation of an oligomeric structure, a motif that is characteristic only to the nicotinate compound. These pieces of information and the rationalisation of the experimental Sn-119 Mossbauer nuclear quadrupole splittings, Delta, - according to the point charge model forma…

DenticitygeometryX ray diffractionCrystal structureOrganotin(IV)nicotinic acid derivativeBiochemistryInorganic Chemistrycomplex formationMaterials ChemistryMoleculeorganotin compoundcontrolled studyPhysical and Theoretical Chemistryinfrared spectroscopychemical bindinghydrogen bondHydrogen bondChemistryMössbauer spectroscopybinding siteOrganic ChemistryarticleSquare pyramidal molecular geometryX-ray diffractionFT-IRtin derivativeTrigonal bipyramidal molecular geometryCrystallographyOctahedrondicarboxylic acidSettore CHIM/03 - Chimica Generale E Inorganicachemical structureMolecular modellingcarboxylic acidsynthesimolecular modelchemical analysiSingle crystal
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Square wave voltammetric determination of the redox state of a reversibly oxidized/reduced depolarizer in solution and in solid state

2012

Abstract Square wave voltammetric measurements allows for determining the composition of system containing a reversibly reducible/oxidable electroactive species in two oxidation states. The method is based on recording the ratio of reverse to forward peak currents. That ratio can be correlated with the molar fraction of the oxidized (or reduced) form of the depolarizer. The method was compared with cyclic voltammetric methods suggested in literature and it was tested using Fe ( CN ) 6 3 - / Fe ( CN ) 6 4 - in solution phase. Application to solid state systems is illustrated by the dehydroindigo/indigo couple in synthetic Maya Blue-type specimens prepared from indigo plus different clays whe…

DepolarizerChemistryGeneral Chemical EngineeringInorganic chemistrySolid-stateAnalytical chemistrySquare waveMole fractionSolution phaseRedoxIndigoAnalytical ChemistryOxidation stateElectrochemistryJournal of Electroanalytical Chemistry
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Comparative study of reflectance cells for PLS-FTIR determination of sugars in soft drinks

1998

A comparative study has been carried out between a horizontal Attenuated Total Reflectance (h-ATR) cell and a Cylindrical Internal Reflection (CIR) cell (CIRCLE cell). Both cells were employed for the determination of glucose, fructose, sucrose and total sugar in soft drinks and fruit juices using absorbance measurements at two resolution values (4 and 8 cm–1). Data were processed by Partial Least Squares regression (PLS). Using a resolution of 4 cm–1, mean relative errors of prediction from 0.6% to 1.3% were obtained using the horizontal-ATR and from 0.6% to 2.8% using the CIRCLE cell resulting in a limit of detection from 0.03% in the case of sucrose to 0.21% for total sugar for the h-ATR…

Detection limitAbsorbancechemistry.chemical_compoundSucrosechemistryAttenuated total reflectionPartial least squares regressionAnalytical chemistryFructoseSugarBiochemistryQuantitative analysis (chemistry)Fresenius' Journal of Analytical Chemistry
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Analyser of chromium and/or cobalt

2003

Abstract Two stopped-flow manifolds have been proposed for individual or simultaneous determination of chromium and cobalt in water samples. Automated procedures based on multicommutation systems have emphasised the differences of their catalytic effect in luminol–hydrogen peroxide chemiluminescence reaction. A more rapid decay of signal was observed for Co for both configurations (flow injection or continuous injection). The influence of chemical and hydrodynamic variables has been studied in order to establish the robustness of method. The analysis rate was lower 1.5 min per replicate. Chemometric tools have been employed for the resolution of their contributions. Partial least squares (P…

Detection limitAnalyserAnalytical chemistrychemistry.chemical_elementBiochemistryAnalytical ChemistryChemometricsChromiumCertified reference materialschemistryStandard additionPartial least squares regressionEnvironmental ChemistryCobaltSpectroscopyAnalytica Chimica Acta
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Selection of calibration set samples in determination of olive oil acidity by partial least squares–attenuated total reflectance–Fourier transform in…

2003

Abstract A chemometric method has been applied for the determination of the free fatty acid (FFA) concentration in commercial olive oil samples of different types an origins by using Fourier transform infrared spectroscopy (FTIR) attenuated total reflectance (ATR) measurements. Different methods for selecting the training set, including hierarchical cluster analysis, were applied and compared. The prediction capabilities of partial least squares (PLS) multivariate calibration methods, net analyte signal (NAS) preprocessing followed by PLS or classical least squares (CLS) regression method of ATR–FTIR data were evaluated. Several aspects, like spectral range to be considered, different prepr…

Detection limitAnalyteMean squared errorChemistryAnalytical chemistryBiochemistryFourier transform spectroscopyStandard deviationAnalytical ChemistryChemometricsPartial least squares regressionCalibrationEnvironmental ChemistrySpectroscopyAnalytica Chimica Acta
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Determination of edible oil parameters by near infrared spectrometry

2006

Abstract A chemometric method has been developed for the determination of acidity and peroxide index in edible oils of different types and origins by using near infrared spectroscopy (NIR) measurements. Different methods for selecting the calibration set, after an hierarchical cluster analysis, were applied. After discrimination of olive oils from maize, seed and sunflower, the prediction capabilities of partial least squares (PLS) multivariate calibration of NIR data were evaluated. Several preprocessing alternatives (first derivative, multiplicative scatter correction, vector normalization, constant offset elimination, mean centering and standard normal variate) were investigated by using…

Detection limitChromatographyAnalytical chemistryNear-Infrared SpectrometryBiochemistryPeroxideSunflowerAnalytical ChemistryChemometricschemistry.chemical_compoundchemistryPartial least squares regressionCalibrationEnvironmental ChemistryPeroxide valueSpectroscopyAnalytica Chimica Acta
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Ligand effects on the structures and magnetic properties of tricyanomethanide-containing copper(II) complexes.

2007

The preparation, crystal structure and magnetic properties of four heteroleptic copper(II) complexes with the tricyanomethanide (tcm(-)) and the heterocyclic nitrogen donors 3,6-bis(2-pyridyl)pyridazine (dppn), 2,5-bis(2-pyridyl)pyrazine (2,5-dpp), 2,3-bis(2-pyridyl)pyrazine (2,3-dpp) and 2,3-bis(2-pyridyl)quinoxaline (2,3-dpq) are reported, {[Cu(2)(dppn)(OH)(tcm)(2)] x tcm}(n) (1), {[Cu(2,5-dpp)(tcm)] x tcm}(n) (2), {[Cu(2)(2,3-dpp)(2)(tcm)(3)(H(2)O)(0.5)] x tcm x 0.5H(2)O}(n) (3) and [Cu(2,3-dpq)(tcm)(2)](n) (4). 1 has a ladder-like structure with single mu-1,5-tcm ligands forming the sides and a bis-bidentate dppn and a single mu-hydroxo providing the rung. Each copper atom in 1 exhibits…

DiazineModels MolecularDenticityPyrazineMolecular StructureSpectrophotometry InfraredStereochemistryLigandTemperatureCrystal structureCrystallography X-RayLigandsSquare pyramidal molecular geometryInorganic ChemistryPyridazineTrigonal bipyramidal molecular geometrychemistry.chemical_compoundCrystallographyMagneticschemistryNitrilesOrganometallic CompoundsCopperDalton transactions (Cambridge, England : 2003)
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