Experimental and theoretical investigations of the antioxidant activity of 2,2′‐methylenebis(4,6‐dialkylphenol) compounds
Sign Up to like & getrecommendations! Published in 2017 at "Applied Organometallic Chemistry"
DOI: 10.1002/aoc.3562
Abstract: The antioxidant activity of two primary antioxidants, 2,2′-methylenebis(4-methyl-6-tert-butylphenol) (MMBPH2) and 2,2′-methylenebis(4,6-di-tert-butylphenol) (MDBPH2), has been studied using the 1,1-diphenyl-2-picrylhydrazyl (DPPH) method. The synthesized compounds have been successfully characterized systematically using elemental analyses, infrared, 1H NMR and… read more here.
Keywords: antioxidant activity; investigations antioxidant; theoretical investigations; experimental theoretical ... See more keywords
Experimental and theoretical studies of new Co(III) complexes of hydrazide derivatives proposed as multi‐target inhibitors of SARS‐CoV‐2
Sign Up to like & getrecommendations! Published in 2022 at "Applied Organometallic Chemistry"
DOI: 10.1002/aoc.6836
Abstract: Cobalt(III) complexes with Schiff base ligands derived from hydrazone, (HL 1 = (E)‐N′‐(3,5‐dichloro‐2‐hydroxybenzylidene)‐4‐hydroxybenzohydrazide, HL 2 = (E)‐N′‐(3,5‐dichloro‐2‐hydroxybenzylidene)‐4‐hydroxybenzohydrazide (3,5‐dibromo‐2‐hydroxybenzylidene), and HL 3 = (E)‐4‐hydroxy‐N′‐(2‐hydroxy‐3‐ethoxybenzylidene)benzohydrazide), were synthesized and characterized by elemental analysis, Fourier transform infrared (FT‐IR) spectroscopy, UV–Vis spectroscopy, and… read more here.
Keywords: experimental theoretical; iii complexes; spectroscopy; iii ... See more keywords
Experimental and theoretical rationalization for the base pairing abilities of inosine, guanosine, adenosine, and their corresponding 8‐oxo‐7,8‐dihydropurine, and 8‐bromopurine analogues within A‐form duplexes of RNA
Sign Up to like & getrecommendations! Published in 2020 at "Biopolymers"
DOI: 10.1002/bip.23410
Abstract: Inosine is an important RNA modification, furthermore RNA oxidation has gained interest due, in part, to its potential role in the development/progression of disease as well as on its impact on RNA structure and function.… read more here.
Keywords: pairing abilities; corresponding oxo; base pairing; base ... See more keywords
A Detailed Experimental and Theoretical Study of the Crystalline and Electronic Structure of BaHf(1−x)Zr x S3 Solid Solutions (0 ≤ x ≤ 1)
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DOI: 10.1002/cphc.202500466
Abstract: Solid solutions of the chalcogenide perovskites BaHfS3 and BaZrS3 are synthesized and studied in detail across the entire composition interval by X‐ray diffraction, UV‐vis spectroscopy, and theoretical calculations. The results obtained extend those previously obtained… read more here.
Keywords: solid solutions; study crystalline; detailed experimental; structure ... See more keywords
Recent experimental and theoretical studies on protein crystallization
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DOI: 10.1002/crat.201600210
Abstract: Crystals are required to determine three-dimensional structures of proteins and other bio-molecules via X-ray diffraction. This is the prime cause for the keen interest in protein crystallization. Recently published experimental and theoretical studies on protein… read more here.
Keywords: theoretical studies; crystallization; studies protein; experimental theoretical ... See more keywords
Experimental and Theoretical Insights into the Role of Iron in the Rapidly Fabricated Ni/Fe Electrodes for the Oxygen Evolution Reaction
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DOI: 10.1002/cssc.202500281
Abstract: The development of low‐cost electrocatalysts for the oxygen evolution reaction (OER) of water electrolysis is crucial for large‐scale green hydrogen production. NiFe‐based electrocatalysts have garnered significant attention due to their high OER activity; however, the… read more here.
Keywords: experimental theoretical; evolution reaction; oxygen evolution; role ... See more keywords
An N‐heterocyclic Carbene TCNE Zwitterion: Experimental and Theoretical Study on its Formation and Reactivity
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DOI: 10.1002/ejoc.201601648
Abstract: A direct addition of tetracyanoethylene (TCNE) at the carbene center of 1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene (IPr) has been successfully demonstrated. The IPr-TCNE adduct, zwitterion 1, clearly differs from the typical products of [2+1] cyclization obtained from the reaction… read more here.
Keywords: study; tcne; reactivity; carbene ... See more keywords
Experimental and Theoretical Study of the Ultrafast Dynamics of a Ni2 Dy2 -Compound in DMF After UV/Vis Photoexcitation.
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DOI: 10.1002/open.202200086
Abstract: Invited for this month's cover picture are the groups of Wolfgang Hübner (TU Kaiserslautern, Germany), Annie Powell (Karlsruhe Institut of Technology, Germany), and Andreas-Neil Unterreiner (Karlsruhe Institut of Technology, Germany). The cover picture shows the… read more here.
Keywords: ultrafast dynamics; ni2 dy2; experimental theoretical; theoretical study ... See more keywords
Experimental and Theoretical Study of Strong Low-Terahertz Absorption of Thymine
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DOI: 10.1007/s10762-017-0420-z
Abstract: The absorption coefficient of a nucleobase-thymine-in powder form was measured with terahertz spectroscopy in both frequency- and time-domain experiments. For frequencies below 3 THz, a strong signature was observed at 1.27 THz. Furthermore, molecular-dynamic simulations… read more here.
Keywords: absorption; theoretical study; experimental theoretical; study strong ... See more keywords
Experimental and Theoretical Study on Terahertz Absorption Characteristics and Spectral De-noising of Three Plant Growth Regulators
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DOI: 10.1007/s10762-018-0507-1
Abstract: Accurate identification of terahertz (THz) absorption peaks of biological macromolecules is of great significance in practical applications. In this work, the experimental and theoretical fundamentals of detecting three plant growth regulators (PGRs), including 6-Benzylaminopurine (6-BA),… read more here.
Keywords: absorption; three plant; growth regulators; spectral noising ... See more keywords
Photophysics of Dihydroquinazolinone Derivatives: Experimental and Theoretical Studies
Sign Up to like & getrecommendations! Published in 2017 at "Journal of Fluorescence"
DOI: 10.1007/s10895-017-2051-0
Abstract: Herein, we report the synthesis of two dihydroquinazolinone derivative 2-(2-Hydroxy-naphthalen-1-yl)-2, 3-dihydro-1H-quinazolin-4-one (1) and 2-(3-Methyl-thiophen-2-yl)-2,3-dihydro-1H-quinazolin-4-one (2) by using 2-aminobenzamide, 2-hydroxybenzaldehyde and 3-methyl thiophene-2-carboxaldehyde. The synthesized compounds were characterized by 1H NMR, 13C NMR, FT-IR and its… read more here.
Keywords: theoretical studies; dihydroquinazolinone derivatives; photophysics dihydroquinazolinone; derivatives experimental ... See more keywords