Articles with "spectral structural" as a keyword



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Spectral, structural and theoretical studies of α‒methyl trans cinnamaldehyde semicarbazone

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Published in 2019 at "Journal of Molecular Structure"

DOI: 10.1016/j.molstruc.2019.01.041

Abstract: Abstract A novel semicarbazone, α‒methyl trans cinnamaldehyde semicarbazone has been synthesized and characterized by elemental analysis, FT-IR, FT-Raman, NMR and UV-Visible spectral techniques. The single crystal X-ray diffraction study of the isolated crystals of the… read more here.

Keywords: methyl trans; theoretical studies; trans cinnamaldehyde; structural theoretical ... See more keywords
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Spectral and structural properties of carotenoids - DFT and thermochemical calculations

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Published in 2019 at "Journal of Molecular Structure"

DOI: 10.1016/j.molstruc.2019.07.067

Abstract: Abstract The published data on Raman νC=C values of carotenoids and some polyenes with the number of conjugated C=C bonds (NC=C) up to 19 were tabulated. The experimental data were compared with the DFT calculated… read more here.

Keywords: carotene; carotene homologues; properties carotenoids; carotenoids dft ... See more keywords
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Regioselective 2,3-Disubstituted Porphyrins: Synthesis, Spectral, Structural and Electrochemical Properties

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Published in 2023 at "New Journal of Chemistry"

DOI: 10.1039/d3nj01288c

Abstract: A series of regioselective β-disubstituted meso-tetraphenylporphyrins, H2TPP(X)2 where X = methyl (CH3), phenyl (Ph) and phenylethynyl (PE) as well their metal complexes (Cu(II), Co(II), Ni(II) and Zn(II)) were synthesized and... read more here.

Keywords: structural electrochemical; spectral structural; regioselective disubstituted; porphyrins synthesis ... See more keywords
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Synthetic, spectral, structural and catalytic activity of 3-D metal formats/acetates framework materials for CO2 conversion

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Published in 2023 at "New Journal of Chemistry"

DOI: 10.1039/d3nj01463k

Abstract: Two new coordination polymers [Cu2(HCO2)2(H2O)2]n(1), and [Na{Ni(CH3CO2)2(CH3CO2H)}]n (2) were synthesized using a mild solution chemistry approach and characterized spectroscopically and the molecular structures of 1, and 2 were determined by... read more here.

Keywords: structural catalytic; activity metal; chemistry; spectral structural ... See more keywords
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Spectral, structural and theoretical study of novel helical and linear structures of PbI2 and PbBr2 complexes with a triazine ligand

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Published in 2019 at "Journal of Coordination Chemistry"

DOI: 10.1080/00958972.2019.1619707

Abstract: Abstract Two coordination polymers of lead(II), 1D-{Pb(DFPT)(μ-Br)2}n (1) and 1D-helical-{Pb(DFPT)(μ-I)2}n (2), with 5,6-di(furan-2-yl)-3-(pyridin-2-yl)-1,2,4-triazine (DFPT) were prepared and identified by elemental analysis, FT-IR, 1H NMR spectroscopy and single-crystal X-ray diffraction. In the 1D-double chain-coordination polymers of… read more here.

Keywords: study novel; coordination; theoretical study; structural theoretical ... See more keywords
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Developing Spectral Structural Complexity Metrics

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Published in 2019 at "IEEE Systems Journal"

DOI: 10.1109/jsyst.2019.2912368

Abstract: There are various approaches to measure the complexity of engineered systems. The structural approach to the measurement of system complexity is only one of the possible routes that are currently under consideration. This approach considers… read more here.

Keywords: system; complexity metrics; structural complexity; approach ... See more keywords
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Spectral and Structural Characteristics for Cluster Systems of Charged Brownian Particles

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Published in 2018 at "Journal of Experimental and Theoretical Physics"

DOI: 10.1134/s1063776118070142

Abstract: We report on the results of analytic and numerical investigations of the dynamics for bounded ensembles of charged Brownian particles in the potential field of an electrostatic trap. Simulation has been performed for cluster systems… read more here.

Keywords: structural characteristics; characteristics cluster; charged brownian; cluster systems ... See more keywords