Electronic properties and reactivity of oxidized graphene nanoribbons and their interaction with phenol
Sign Up to like & getrecommendations! Published in 2021 at "Journal of Molecular Modeling"
DOI: 10.1007/s00894-021-05002-w
Abstract: The effect of the oxidized functional groups on the structural, electronic, and reactivity properties of armchair graphene nanoribbons has been investigated in the framework of the density functional theory. The presence of functional groups near… read more here.
Keywords: graphene nanoribbons; oxidized graphene; interaction; properties reactivity ... See more keywords
A study of the properties, reactivity and anticancer activity of novel N-methylated-3-thiazolyl or 3-thienyl carbazoles and their Pd(II) and Pt(II) complexes.
Sign Up to like & getrecommendations! Published in 2018 at "Journal of inorganic biochemistry"
DOI: 10.1016/j.jinorgbio.2018.03.008
Abstract: Abstract The synthesis and characterization of two hybrid N-methylated carbazole derivatives containing a thiazolyl or a thienyl ring is reported. The thiazolyl derivative has been also characterised by X-ray diffraction analysis. The study of its… read more here.
Keywords: study properties; properties reactivity; thienyl; activity ... See more keywords
Structures, electronic properties, reactivity and dynamic studies of three new polyoxometalate compounds.
Sign Up to like & getrecommendations! Published in 2018 at "Dalton transactions"
DOI: 10.1039/c8dt02205d
Abstract: We report a complex study on the crystal structures, electronic properties, reactivity and dynamics of three polyoxometalate compounds (C6NH8)4[H2P2Mo5O23]·5H2O (1), (C2H8N)5[HP2Mo5O23]·(C3H9NO2)0.5·(H2O)1.5 (2) and (C2H8N)3[PMo12O40]·(H2O)0.34 (3). These compounds were synthesized using a solution method and characterized… read more here.
Keywords: polyoxometalate compounds; reactivity dynamic; structures electronic; electronic properties ... See more keywords
Properties and reactivity of sulfidized nanoscale zero-valent iron prepared with different borohydride amounts
Sign Up to like & getrecommendations! Published in 2021 at "Environmental Science: Nano"
DOI: 10.1039/d1en00364j
Abstract: The liquid-phase reduction method with NaBH4 as the reductant is the most widely used method for sulfidized nanoscale zerovalent iron (SNZVI) synthesis. However, it is unclear how the reductant amount... read more here.
Keywords: sulfidized nanoscale; nanoscale zero; reactivity sulfidized; properties reactivity ... See more keywords
Molecular Structure, Electronic Properties, Reactivity (ELF, LOL, and Fukui), and NCI-RDG Studies of the Binary Mixture of Water and Essential Oil of Phlomis bruguieri
Sign Up to like & getrecommendations! Published in 2023 at "Molecules"
DOI: 10.3390/molecules28062684
Abstract: Essential oils are volatile oil-like liquids with a characteristic strong smell and taste. They are formed in plants and are then extracted. Essential oils have extremely strong physiological and pharmacological properties, which are used in… read more here.
Keywords: properties reactivity; oil; water; essential oil ... See more keywords