Keywords: ساختار مولکولی; Sucralose; Vibrational spectra; Molecular structure; Force field; DFT calculations;
مقالات ISI ساختار مولکولی (ترجمه نشده)
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در صورتی که به ترجمه آماده هر یک از مقالات زیر نیاز داشته باشید، می توانید سفارش دهید تا مترجمان با تجربه این مجموعه در اسرع وقت آن را برای شما ترجمه نمایند.
Keywords: ساختار مولکولی; Electrospinning; Nanofibres; Blend; Gelatine polycaprolactone; Molecular structure;
Keywords: ساختار مولکولی; Lignite; Molecular structure; Carbon monoxide generation; Deformation; Temperature
Keywords: ساختار مولکولی; Anaerobic digestion; Primary sludge; Sludge retention time (SRT); Trace organic contaminants; Molecular structure
Keywords: ساختار مولکولی; Flash point; Alcohol; Correlation; Molecular structure; Safety; Phenol derivative
Keywords: ساختار مولکولی; IR analysis; Molecular structure; Dissociation dynamics; Binding energy
Keywords: ساختار مولکولی; Melting point; Organic azide; Molecular structure; Correlation
Keywords: ساختار مولکولی; Group-interaction contribution; Ionic liquids; Glass transition temperature; Molecular structure; Property estimation
Structural studies of polycrystalline octavinyloctasilsesquioxane - (C2H3)8Si8O12
Keywords: ساختار مولکولی; Octavinyloctasilsesquioxane; Crystal structure; Molecular structure; X-ray powder diffraction; Infrared spectroscopy;
Structural and spectroscopic differences among the potassium 5-hydroxypentanoyltrifluoroborate salt and the furoyl and isonicotinoyl salts
Keywords: ساختار مولکولی; Potassium 5-hydroxypentanoyltrifluoroborate salt; Vibrational spectra; Molecular structure; Force field; DFT calculations;
Synthesis and characterization of azathiaethers macrocyclic rings decorated with one or two 2-pyridylmethyl fragments
Keywords: ساختار مولکولی; Azathiaethers macrocycles; Macrocyclization; N-alkylation; Rectangular conformation; Molecular structure; Noncovalent interactions;
FT-IR, FT-Raman, UV-Vis, NMR and structural studies of carquejyl acetate, a distinctive component of the essential oil from Baccharis trimera (less.) DC. (Asteraceae)
Keywords: ساختار مولکولی; Carquejyl acetate; Baccharis trimera; Vibrational spectra; Molecular structure; Force field; DFT calculations;
DFT and vibrational spectroscopy study of 1-butyl-3-methylimidazolium trifluoromethanesulfonate ionic liquid
Keywords: ساختار مولکولی; 1-Butyl-3-methylimidazolium trifluoromethanesulfonate; Vibrational spectra; Conformations; Molecular structure; Descriptor properties; DFT calculations;
Isolation and structural characterization of a polysaccharide derived from a local gum: Zedo (Amygdalus scoparia Spach)
Keywords: ساختار مولکولی; Zedo gum; Polysaccharide; Characterization; Chemical composition; Molecular structure;
Microwave spectrum and structure of the lowest A - internal rotor state of Arâ
â
â
CH3I
Keywords: ساختار مولکولی; Methyl iodide-argon complex; Microwave spectroscopy; Molecular structure; Iodine nuclear quadrupole coupling;
Double trap: A single product from the THF-initiated interception of a cyclopropylidene(oid) and its rearranged strained cyclic allene
Keywords: ساختار مولکولی; Carbene(oid); Strained cyclic allene; Oxonium ylid; Rearrangements; Molecular structure;
Effect of molecular structure of the N, Nâ²-bis(2-hydroxy-1-naphthaldehyde)-1,3-phenylenediimine ligand on the electrocatalytic properties of its Ni(II) complex for reduction of CO2
Keywords: ساختار مولکولی; Schiff base; Ni(II) complex; Molecular structure; Electrocatalyst; CO2 reduction;
The molecular structure of 4-methylpyridine-N-oxide: Gas-phase electron diffraction and quantum chemical calculations
Keywords: ساختار مولکولی; 4-methylpyridine-N-oxide; Gas-phase electron diffraction; Quantum chemical calculations; Molecular structure; NBO analysis;
Microheterogeneity in CH3OH/CD3OH mixture
Keywords: ساختار مولکولی; Binary mixtures; Methanol; Methanolâd3; Liquid phase; Molecular structure; Microheterogeneity; Hydrogen bonding; Spectroscopy; ATR-IR; NIR; 2D correlation analysis; Chemometrics; MCR-ALS; Excess spectra; DFT;
The low internal rotation barriers of halogenated toluenes: Rotational spectrum of 2,4-difluorotoluene
Keywords: ساختار مولکولی; 2,4-Difluorotoluene; Internal rotation; Microwave spectroscopy; Molecular structure;
Bioactive chemical constituents of Duboscia macrocarpa Bocq., and X-ray diffraction study of 11β, 12β-epoxyfriedours-14-en-3α-ol
Keywords: ساختار مولکولی; Duboscia macrocarpa Bocq.; Triterpenes; Evodoulolide; Duboscic acid B; Molecular structure;
Pamoic acid-phenanthroline co-crystal and its Cu(II) complex: X-ray structures and luminescence properties
Keywords: ساختار مولکولی; Proton-transfer complex; Pamoic acid; Phenanthroline; Cu(II) complex; Molecular structure; Absorption and emission;
The molecular structure of 5-X-isatines where (XÂ =Â F, Cl, and Br) determined by gas-phase electron diffraction with theoretical calculations
Keywords: ساختار مولکولی; Molecular structure; Gas-phase electron diffraction; Aromaticity; Induced current density; Condensed Fukui functions; Reactivity; NBO; NICS; HOMA; ACID; ICSS;
Investigation of the activity of Acinetobacter calcoaceticus biodemulsifier to break stable water in oil emulsions
Keywords: ساختار مولکولی; Biodemulsifier; Molecular structure; O/W emulsion; Stability; Optimization;
Molecular and conformational properties of hemicellulose fiber gum from dried distillers grains with solubles
Keywords: ساختار مولکولی; NMR; Arabinoxylan; Molecular structure; Hemicellulose; Dried distillers grains with solubles;
Characterisation of subfractions of asphaltenes extracted from an oil sand using NMR, DEPT and MALDI-TOF
Keywords: ساختار مولکولی; Asphaltenes; DEPT; Molecular structure; NMR; Oil sand; Fractions;
Cyanocyclohexane: Axial-to-equatorial “seesaw” parity in gas and condensed phases
Keywords: ساختار مولکولی; Cyanocyclohexane; Gas-phase electron diffraction; Dynamic NMR; Quantum chemical calculations; Equatorial-to-axial equilibrium; Molecular structure;
Degradation of fluorinated polyurethane coating under UVA and salt spray. Part â
¡: Molecular structures and depth profile
Keywords: ساختار مولکولی; Fluorinated polyurethane coating; Degradation depth profile; Molecular structure; Confocal Raman microscopy;
1-Methoxy-1-silacyclohexane: Synthesis, molecular structure and conformational behavior by gas electron diffraction, Raman spectroscopy and quantum chemical calculations
Keywords: ساختار مولکولی; 1-Methoxy-1-silacyclohexane; Molecular structure; Conformational analysis; Gas electron diffraction; Raman spectroscopy; Quantum chemical calculations;
Nano properties analysis via fourth multiplicative ABC indicator calculating
Keywords: ساختار مولکولی; Theoretical nanoscience; Molecular structure; Fourth multiplicative atom-bond connectivity index; Dendrimer;
Emulsifying stability properties of octenyl succinic anhydride (OSA) modified waxy starches with different molecular structures
Keywords: ساختار مولکولی; OSA-starch; Molecular structure; Interfacial property; Emulsion property; Stability;
FT-IR, FT-Raman and UV-visible spectra of potassium 3-furoyltrifluoroborate salt
Keywords: ساختار مولکولی; Potassium 3-furoyltrifluoroborate salt; Vibrational spectra; Molecular structure; Force field; DFT calculations;
Structural analysis and antioxidant activity of the glycoside from Imperial Chrysanthemum
Keywords: ساختار مولکولی; Imperial Chrysanthemum glucoside; Isolation and purification; Antioxidant; Molecular structure;
Interactions, induced by heating, of whey protein isolate (WPI) with sugar beet pectin (SBP) in solution: Comparisons with a dry-state Maillard reaction
Keywords: ساختار مولکولی; Whey protein isolate; Sugar beet pectin; Maillard reaction; Molecular structure; Spectroscopy; Thermal stability;
Structural and vibrational study of a neurotransmitter molecule: Dopamine [4-(2-aminoethyl) benzene-1,2-diol]
Keywords: ساختار مولکولی; DFT; HOMO-LUMO; Molecular structure; NBO; Vibrational; IR and Raman spectra;
Globular molecular platinum carbonyl nanoclusters: Synthesis and molecular structures of the [Pt26(CO)32]â and [Pt14+x(CO)18+x]4â anions and their comparison to related platinum “browns”
Keywords: ساختار مولکولی; Cluster compound; Carbonyl ligand; Platinum; Molecular structure; Nanocluster;
Synthesis, crystal growth, thermal and laser damage threshold properties of new Schiff base NLO material 4-Nitro-benzoic acid (3-ethoxy-2-hydroxy-benzylidene)-hydrazide
Keywords: ساختار مولکولی; Schiff base; Organic material; Crystal growth; Molecular structure; Second harmonic generation; Thermal analysis;
Curve-linear relationship between altered carbohydrate traits with molecular structure and truly absorbed nutrient supply to dairy cattle in new hulless barley (Hordeum vulgare L.)
Keywords: ساختار مولکولی; ABCP; truly absorbed bypass protein in the small intestine; AECP; truly absorbed rumen endogenous protein in the small intestine; AMCP; truly absorbed microbial protein in the small intestine; ARUP; truly absorbed rumen undegradable protein in the small i
Synthesis, structures and antimicrobial activity of 5-nitro-salicylaldehyde-thiosemicarbazonates of zinc(II) coordinated to substituted bipyridines/phenanthrolines
Keywords: ساختار مولکولی; Thiosemicarbazones; Zinc; Antimicrobial activity; Molecular structure; Substituted bipyridines;
Synthesis, structures, and ESI-mass studies of silver(I) derivatives of imidazolidine-2-thiones: Antimicrobial potential and biosafety evaluation
Keywords: ساختار مولکولی; Silver(I) halides; Imidazolidine-2-thiones; Cellular toxicity; Antimicrobial activity; Molecular structure;
Synthesis, structural studies and antimicrobial activities of manganese, nickel and copper complexes of two new tridentate 2âformylpyridine thiosemicarbazone ligands
Keywords: ساختار مولکولی; Thiosemicarbazones; Tridentate ligands; Schiff base complexes; Molecular structure; Antimicrobial activity;
Ultra-high performance liquid chromatography-size exclusion chromatography (UPLC-SEC) as an efficient tool for the rapid and highly informative characterisation of biopolymers
Keywords: ساختار مولکولی; Starch; UPLC; Size exclusion chromatography; Molecular structure; Chain length distribution;
Structural and vibrational characterization of anhydrous and dihydrated species of trehalose based on the FTIR and FTRaman spectra and DFT calculations
Keywords: ساختار مولکولی; Trehalose; Molecular structure; Vibrational spectra; DFT calculations; Force field;
Structural sensitivity of CH vibrational band in methyl benzoate
Keywords: ساختار مولکولی; Molecular structure; Vibrational spectroscopy; VSCF method; Anharmonic frequency; Red shift;
The crystal and molecular structure of C.I.Pigment Yellow 155, a high performance bisacetoacetarylide disazo yellow pigment
Keywords: ساختار مولکولی; Crystal structure; Molecular structure; C. I. pigment yellow 155; Bisacetoacetarylide disazo; Organic pigment;
Experimental and theoretical vibrational study of N-carbamoyl-L-proline
Keywords: ساختار مولکولی; N-Carbamoyl-L-proline; Molecular structure; Vibrational spectra; Force field; DFT calculation;
Molecular modeling and physicochemical properties of 1-alkyl-3-methylimidazolium-FeX4 and -Fe2X7 (X = Cl and Br) magnetic ionic liquids
Keywords: ساختار مولکولی; Magnetic ionic liquids; DFT calculations; Molecular structure; Physicochemical properties; COSMO-RS method;
Molecular structure, Hirshfeld surface analysis, spectroscopic (FT-IR, Laser-Raman, UV-vis. and NMR), HOMO-LUMO and NBO investigations on N-(12-amino-9,10-dihydro-9,10-ethanoanthracen-11-yl)-4-methylbenzenesulfonamide
Keywords: ساختار مولکولی; N-(12-amino-9,10-dihydro-9,10-ethanoanthracen-11-yl)-4-methylbenzenesulfonamide; Molecular structure; Hirshfeld surface analysis; Vibrational spectroscopy; NMR chemical shifts; UV-Vis. spectroscopy;
Photochemical dynamics of a trimethyl-phosphine derivatized [FeFe]-hydrogenase model compound
Keywords: ساختار مولکولی; Hydrogenase models; Ultrafast; Time-resolved vibrational spectroscopy; Reaction dynamics; Photochemical isomerization; Molecular structure;
Ab initio calculations, structure, NBO and NCI analyses of XHâ¯Ï interactions
Keywords: ساختار مولکولی; XHâ¯Ï interactions; Molecular structure; Ab initio; Random-phase approximation; NCI;