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X-Ray Diffraction Analysis for Starch
Starch is a polysaccharide generated by plants as a form of energy storage. The combination of the two macromolecules amylose and amylopectin, in...
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Single-crystal X-ray diffraction study of 4,5-diaryl-3-hydroxy-2,2′-bipyridine-6-carbonitriles
Five representatives of 4,5-diaryl-substitted 3-hydroxy-2,2′-bipyridine-6-carbonitriles were studied by single-crystal X-ray diffraction. The...
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Single-crystal X-ray diffraction analysis of arylamine-containing 2,2′-bipyridine derivatives
The structures of six 2,2′-bipyridine derivatives containing aromatic amine moieties, namely N -aryl-4-aryl-1-(pyridin-2-yl)-6,7-dihydro-5 H -cyclopenta[
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Conformational investigations on three large dinuclear triple helicates by single crystal X-ray diffraction
Three new dinuclear triple helicates were synthesised using a ditopic semi-rigid pyridylylimine ligand L , separated by a diphenoxy-biphenol spacer...
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Crystal Structure of Nilotinib Hydrochloride Monohydrate According to Powder X-Ray Diffraction Data
AbstractThe crystal structure of nilotinib hydrochloride monohydrate, being an active pharmaceutical substance of the drug Tasigna for chronic...
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Type II Halogen-Halogen Contacts in the Single-Crystal X-ray Diffraction Structure of a 1:1 Halogen-Bonded Cocrystal of 2,3,5,6-Tetramethylpyrazine and 1,3,4,5-Tetrabromo-2,6-difluorobenzene
A cocrystal of 2,3,5,6-tetramethylpyrazine and 1,3,4,5-tetrabromo-2,6-difluorobenzene has been prepared and its crystal structure has been determined...
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In situ single-crystal synchrotron X-ray diffraction studies of biologically active gases in metal-organic frameworks
Metal-organic frameworks (MOFs) are well known for their ability to adsorb various gases. The use of MOFs for the storage and release of biologically...
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Charge Transfer Complexes of 9
H -Fluoren-9-One Derivatives with 9-Methyl-9H -Carbazole: Quantum Chemical Simulation, Single Crystal X-Ray Diffraction AnalysisAbstractBased on DFT quantum chemical calculations, data on the structures and properties of charge transfer complexes of 9 H -fluoren-9-one...
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X-Ray Diffraction Analysis Methods of Material Characterization and Mechanism Research
The second chapter introduces the phase qualitative and quantitative analysis methods of X-ray diffraction for the phase structure analysis of...
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X-Ray Methods
Three types of X-ray method, viz., X-ray absorption, X-ray fluorescence and X-ray diffraction methods are normally available.
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Synthesis, Hirshfeld Surface, FTIR Analysis and Single Crystal X-Ray Structure of 2-Amino-3-Hydroxypyridinium Saccharinate
AbstractThe title compound 2-amino-3-hydroxypyridinium saccharinate (AHPSAC) was synthesized and the obtaining single crystal was characterized by...
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Oxygen ion vacancies in strontium cobalt oxides: neutron and X-ray diffraction study
Structural analysis of the three different phases of strontium cobalt oxide has been performed at room temperature using X-ray and neutron...
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Density Estimation Method for Individual Compounds from X-Ray Diffraction Analysis of their Solvated Forms
Growth of the single crystals by solvent evaporation from solutions is frequently accompanied by the inclusion of solvent molecules into the crystal...
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Growth, X-ray Diffraction and Dielectric Characterization of Pb5WO8 Single Crystals in the PbO–WO3 System
AbstractSingle crystals of the Pb 5 WO 8 phase were grown in the PbO–WO 3 system by crystallization of (1 – x )PbO· x WO 3 ( x = 0.15–0.20) mixed melts....
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Dynamical Theory of Parametric X-ray Radiation
Previous chapters demonstrate a close analogue between the theory of parametric X-ray radiation (PXR) in thin crystals and the kinematic theory of...
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X-Ray Fluorescence Analysis (XRF)
As already mentioned in ► Chap. 20 : Of all the analytical methods presented in this section, only X-ray...
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Applications of Evolutionary Computation in Structure Determination from Diffraction Data
Evolutionary algorithms are finding increasing use in the study of a wide range of different types of diffraction data. In this chapter, we review...
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Synthesis, Single Crystal X-Ray, Hirshfeld Surface Analysis and DFT Calculation Based NBO, HOMO–LUMO, MEP, ECT and Molecular Docking Analysis of
N ′-[(2,6-Dichlorophenyl)Methylidene]-2-{[3-(Trifluoromethyl)Phenyl]Amino}BenzohydrazideAbstractA new Schiff base compound of N′-[(2,6-dichlorophenyl)methylidene]-2-{[3-(trifluoro-methyl)phenyl] amino}benzohydrazide was synthesized and...
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Synthesis, Characterization and Single Crystal X-Ray Structures of Trifluroacetylacetonate Copper(II) Complexes
Three Cu(II) complexes of 1,1,1-trifluoroacetylacetonate, viz. [Cu(TFACAC) 2 (MeOH)] ( 1 ), [Cu(TFACAC) 2 (py)] ( 2 ) and [Cu(TFACAC) 2 (DABCO)] ( 3 ) were...
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Impact of hemicelluloses and crystal size on X-ray scattering from atomistic models of cellulose microfibrils
X-ray scattering methods allow efficient characterization of cellulosic materials, but interpreting their results is challenging. By creating...
