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Corrosion Science, ISSN 0010-938X, 07/2016, Volume 108, pp. 23 - 35
[Display omitted] •Different functional groups in imidazole inhibitors modify the corrosion behavior.•Molecular properties can be associated to corrosion... 
B. ​Modelling studies | A. Alloy | B. EIS | C. Acid corrosion | B. Modelling studies | Acid corrosion | BEHAVIOR | MATERIALS SCIENCE, MULTIDISCIPLINARY | METALLURGY & METALLURGICAL ENGINEERING | HCL SOLUTION | Modelling studies | HYDROCHLORIC-ACID SOLUTION | IRON | MILD-STEEL | ADSORPTION | Alloy | EIS | Corrosion | Steel | Carbon steel
Journal Article
Journal of Molecular Structure, ISSN 0022-2860, 10/2017, Volume 1145, pp. 112 - 120
A new series of chrysin derivatives containing the di-(2-picolyl)amine (2a–d) moiety have been designed, synthesized, and treated with PdCl2·2CH3CN allowing... 
DFT GIAO calculations | Chrysin | Molecular structure | Di-(2-picolyl)amine | NMR studies | APOPTOSIS | BIS(2-PYRIDYLMETHYL)AMINE | COPPER(II) | REACTIVITY | CHEMISTRY, PHYSICAL | POLYMERIZATION | ZINC(II) | INTRACELLULAR-DISTRIBUTION | LIGANDS | BIOLOGICAL EVALUATION | DERIVATIVES
Journal Article
Inorganic Chemistry Communications, ISSN 1387-7003, 11/2018, Volume 97, pp. 44 - 48
Two organotin compounds [{D(C6H4CH2)2}SnBr2] displaying intramolecular transannular Sn–D interactions (D = O, 3a; S, 3b) were synthesized by oxidation of... 
Organotin compounds | Hypervalence | DFT | N=0 | NMR | CHALCOGEN-TIN INTERACTIONS | MOLECULAR-STRUCTURES | CHEMISTRY | CRYSTAL | CHEMISTRY, INORGANIC & NUCLEAR | Tin compounds | Heterocyclic compounds | Analysis
Journal Article
INORGANICA CHIMICA ACTA, ISSN 0020-1693, 06/2019, Volume 492, pp. 8 - 17
This work describes the reactions of [(mu-H) M-3(CO)(9)(CCSiMe3)] (M = Ru, Os) with phosphines L (L = PMe3, PMe2Ph, PMePh2, and PPh3) which produce... 
RUTHENIUM CLUSTERS | IRON | MECHANISM | KINETICS | CHEMISTRY, INORGANIC & NUCLEAR
Journal Article
Inorganica Chimica Acta, ISSN 0020-1693, 06/2019, Volume 492, pp. 8 - 17
The reaction of acetylide complexes [(μ-H)M3(CO)9(CCR)] (M = Ru, Os), R = SiMe3, SiPh3) with tertiary phosphines can produce carbonyl substitution complexes or... 
Substitutes | Cleavage | Ruthenium | Phosphines | Structural analysis
Journal Article
Computational and Theoretical Chemistry, ISSN 2210-271X, 02/2018, Volume 1126, pp. 54 - 64
[Display omitted] •The clusters with an even number of atoms have higher stability than odd ones.•The reactivity was analyzed by Fukui functions, HOMO and LUMO... 
DFT | Thioanisole | Aromatic compounds | Quantum mechanics | Anisole | Gold clusters | COMPLEXES | CHEMISTRY | CHEMISTRY, PHYSICAL | ATOMS | POTENTIALS | Sulfur compounds | Analysis | Precious metal products | Catalysis | Derivatives (Financial instruments) | Quantum theory
Journal Article
Food Chemistry, ISSN 0308-8146, 11/2019, Volume 297, p. 124995
•Interaction between α-zein and Ca2+ in nixtamalization was analyzed and described.•The calcium-binding constant of α-zein from nixtamalized flour was... 
Zein | Molecular dynamics simulations | Calcium | Nixtamalization | Protein | MASA | MOLECULAR-DYNAMICS | CONSTANTS | BEHAVIOR | FOOD SCIENCE & TECHNOLOGY | NUTRITION & DIETETICS | INTEGRATION | STARCH | CORN FLOUR | MAIZE | CHEMISTRY, APPLIED | BINDING
Journal Article
DALTON TRANSACTIONS, ISSN 1477-9226, 2015, Volume 44, Issue 31, pp. 13881 - 13889
The reaction of the bis(ethylene) complex [Tp(Me2)Ir(C2H4)(2)] (1) (Tp(Me2) = hydrotris(3,5-dimethylpyrazolyl)borate) with an excess of 2,4-pentanedione... 
H BOND ACTIVATION | THIN-FILMS | TRANSITION | IRIDIUM(III) COMPLEXES | PLATINUM | CRYSTAL-STRUCTURES | PHOTOPHYSICAL PROPERTIES | CYCLIC ETHERS | DERIVATIVES | MOCVD | CHEMISTRY, INORGANIC & NUCLEAR
Journal Article
International Journal of Electrochemical Science, ISSN 1452-3981, 11/2018, Volume 13, Issue 11, pp. 11016 - 11023
Deep eutectic solvents prepared by mixing choline chloride with urea or thiourea (1:2 molar ratio) were employed to evaluate their effects on the formation of... 
Ethylene glycol | Urea | Thiourea | Carbon steel | Deep eutectic solvent | ELECTROCHEMISTRY | thiourea | ZINC | carbon steel | urea | deep eutectic solvent | ALLOYS | ethylene glycol | RESISTANCE | DIFFUSION | IONIC LIQUIDS | LAYER | CHLORIDE
Journal Article