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DFT Studies of Dimethylaminophenyl-Substituted Phthalocyanine and Its Silver Complexes †.
- Published in:
- Molecules, 2024, v. 29, n. 6, p. 1344, doi. 10.3390/molecules29061344
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- Article
On the Jahn–Teller Effect in Silver Complexes of Dimethyl Amino Phenyl Substituted Phthalocyanine †.
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- Molecules, 2023, v. 28, n. 20, p. 7019, doi. 10.3390/molecules28207019
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- Article
Hydrazine Oxidation in Aqueous Solutions I: N 4 H 6 Decomposition.
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- Inorganics, 2023, v. 11, n. 10, p. 413, doi. 10.3390/inorganics11100413
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- Article
On the Potential Role of the (Pseudo-) Jahn–Teller Effect in the Membrane Transport Processes: Enniatin B and Beauvericin.
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- Molecules, 2023, v. 28, n. 17, p. 6264, doi. 10.3390/molecules28176264
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- Article
How Does Pseudo-Jahn-Teller Effect Induce the Photoprotective Potential of Curcumin?
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- Molecules, 2023, v. 28, n. 7, p. 2946, doi. 10.3390/molecules28072946
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- Article
Structural and Biofunctional Insights into the Cyclo(Pro-Pro-Phe-Phe-) Scaffold from Experimental and In Silico Studies: Melanoma and Beyond †.
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- International Journal of Molecular Sciences, 2022, v. 23, n. 13, p. 7173, doi. 10.3390/ijms23137173
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- Article
Quantum‐chemical studies of the antioxidant effectiveness of para‐phenylene diamines.
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- Journal of Vinyl & Additive Technology, 2022, v. 28, n. 2, p. 352, doi. 10.1002/vnl.21901
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- Article
Electronic structure of (MePh<sub>3</sub>P)<sub>2</sub>[Ni<sup>II</sup>(bdtCl<sub>2</sub>)<sub>2</sub>]·2(CH<sub>3</sub>)<sub>2</sub>SO and (MePh<sub>3</sub>P)[Ni<sup>III</sup>(bdtCl<sub>2</sub>)<sub>2</sub>] (bdtCl<sub>2</sub> = 3,6‐dichlorobenzene‐1,2‐dithiolate)
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- Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2021, v. 77, n. 6, p. 919, doi. 10.1107/S2052520621011495
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- Article
DFT Studies of Substituted Phenols Cytotoxicity I. Para‐substituted Phenols.
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- ChemistrySelect, 2021, v. 6, n. 28, p. 7049, doi. 10.1002/slct.202101568
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- Article
Lawsone Derivatives as Efficient Photopolymerizable Initiators for Free-Radical, Cationic Photopolymerizations, and Thiol—Ene Reactions.
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- Polymers (20734360), 2021, v. 13, n. 12, p. 2015, doi. 10.3390/polym13122015
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- Article
Quantum‐chemical study of octafluoro‐spirobi[triphosphazene].
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- International Journal of Quantum Chemistry, 2021, v. 121, n. 10, p. 1, doi. 10.1002/qua.26613
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- Article
A Proline-Based Tectons and Supramolecular Synthons for Drug Design 2.0: A Case Study of ACEI.
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- Pharmaceuticals (14248247), 2020, v. 13, n. 11, p. 338, doi. 10.3390/ph13110338
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- Article
Mass spectrometrical and quantum-chemical study of pentafluorophenylhydrazones.
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- Journal of Mass Spectrometry, 2020, v. 55, n. 10, p. 1, doi. 10.1002/jms.4540
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- Article
Unexpected Cleavage of N‐N Bonds of Pentafluorophenylhydrazones – Formation of Nitriles by a Radical Fragmentation Reaction.
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- ChemistrySelect, 2020, v. 5, n. 13, p. 3929, doi. 10.1002/slct.202001055
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- Article
On shape dependence of the toxicity of rutile nanoparticles.
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- Journal of Nanoparticle Research, 2020, v. 22, n. 3, p. 1, doi. 10.1007/s11051-020-4773-1
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- Article
A Supramolecular Approach to Structure-Based Design with A Focus on Synthons Hierarchy in Ornithine-Derived Ligands: Review, Synthesis, Experimental and in Silico Studies.
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- Molecules, 2020, v. 25, n. 5, p. 1135, doi. 10.3390/molecules25051135
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- Article
Electronic structure of two isostructural 'paddle‐wheel' complexes: a comparative study.
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- Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2018, v. 74, n. 6, p. 681, doi. 10.1107/S2052520618013707
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- Article
Synthesis of Branched‐Chain Sugars with a DHAP‐Dependent Aldolase: Ketones are Electrophile Substrates of Rhamnulose‐1‐phosphate Aldolases.
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- Angewandte Chemie, 2018, v. 130, n. 19, p. 5565, doi. 10.1002/ange.201712851
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- Article
Synthesis of Branched‐Chain Sugars with a DHAP‐Dependent Aldolase: Ketones are Electrophile Substrates of Rhamnulose‐1‐phosphate Aldolases.
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- Angewandte Chemie International Edition, 2018, v. 57, n. 19, p. 5467, doi. 10.1002/anie.201712851
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- Article
Study of reactions of pentafluorophenylhydrazine with activated enol ethers. Synthesis of N-pentafluorophenylpyrazoles.
- Published in:
- ARKIVOC: Online Journal of Organic Chemistry, 2017, v. 2017, p. 446, doi. 10.3998/ark.5550190.p009.659
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- Article
Structural analysis of an impurity of the drug landiolol.
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- 2014
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- Publication type:
- Other
On the Electronic Structure of mer, trans-[RuCl<sub>3</sub>(1 H-indazole)<sub>2</sub>(NO)], a Hypothetical Metabolite of the Antitumor Drug Candidate KP1019: An Experimental and DFT Study.
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- European Journal of Inorganic Chemistry, 2013, v. 2013, n. 14, p. 2505, doi. 10.1002/ejic.201201526
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- Article
Copper(II) Complexes with Schiff Bases Containing a Disiloxane Unit: Synthesis, Structure, Bonding Features and Catalytic Activity for Aerobic Oxidation of Benzyl Alcohol.
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- European Journal of Inorganic Chemistry, 2013, v. 2013, n. 9, p. 1458, doi. 10.1002/ejic.201201080
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- Article
Why is monoalkylation versus bis-alkylation of the Ni(II) complex of the Schiff base of ( S)- N-(2-benzoylphenyl)-1-benzylpyrrolidine-2-carboxamide and glycine so selective? MP2 modelling and topological QTAIM analysis of chiral metallocomplex synthons of α-amino acids used for the preparation of radiopharmaceuticals for positron emission tomography
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- Journal of Radioanalytical & Nuclear Chemistry, 2010, v. 286, n. 3, p. 829, doi. 10.1007/s10967-010-0823-y
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- Article
Photochemical Properties of Camptothecin in the Presence of Copper(II) Ions: The Role of Radicals as Prospective Species in Photodynamic Therapy.
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- Molecular Biotechnology, 2007, v. 37, n. 1, p. 48, doi. 10.1007/s12033-007-0050-0
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- Article
On the Relation Between Conformational Changes and Optical Properties in Oligothiophenes, 2. Linear and Nonlinear Optical Properties.
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- Macromolecular Theory & Simulations, 2001, v. 10, n. 6, p. 592, doi. 10.1002/1521-3919(20010701)10:6<592::AID-MATS592>3.0.CO;2-4
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- Article
Shape memory effect of dehydrochlorinated crosslinked poly(vinyl chloride).
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- Macromolecular Chemistry & Physics, 1997, v. 198, n. 10, p. 3161, doi. 10.1002/macp.1997.021981014
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- Article
On the relation between conformational changes and electronic structure defects in polypyrrole.
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- Macromolecular Theory & Simulations, 1996, v. 5, n. 1, p. 107, doi. 10.1002/mats.1996.040050108
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- Article