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Strong hyperconjugative interactions limit solvent and substituent influence on conformational equilibrium: the case of cis -2-halocyclohexylamines

Beilstein journal of organic chemistry, 2019-04, Vol.15 (1), p.818-829

2019

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Next-Generation Tags for Fluorine Nuclear Magnetic Resonance: Designing Amplification of Chemical Shift Sensitivity

Journal of the American Chemical Society, 2024-02, Vol.146 (5), p.3052-3064

2024

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Novel arylcarbamate-N-acylhydrazones derivatives as promising BuChE inhibitors: Design, synthesis, molecular modeling and biological evaluation

Bioorganic & medicinal chemistry, 2021-02, Vol.32, p.115991, Article 115991

2021

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One-Pot Highly Regioselective Synthesis of α‑Ketoamide N‑Arylpyrazoles from Secondary β‑Enamino Diketones

Organic letters, 2019-08, Vol.21 (16), p.6325-6328

2019

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Synthesis and evaluation against Leishmania amazonensis of novel pyrazolo[3,4-d]pyridazinone-N-acylhydrazone-(bi)thiophene hybrids

European journal of medicinal chemistry, 2016-11, Vol.124, p.340-349

2016

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Synthesis and antifungal activity of new hybrids pyrimido[4,5-d]pyridazinone-N-acylhydrazones

Bioorganic & medicinal chemistry letters, 2020-07, Vol.30 (14), p.127244-127244, Article 127244

2020

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Acidities under the Perspective of Energy Decomposition Analysis

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2017-07, Vol.121 (26), p.4993-5004

2017

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Targeting the Homoserine Dehydrogenase of Paracoccidioides Species for Treatment of Systemic Fungal Infections

Antimicrobial agents and chemotherapy, 2017-09, Vol.61 (9)

2017

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Development of methodologies for the regioselective synthesis of four series of regioisomer isoxazoles from β-enamino diketones

RSC advances, 2018-01, Vol.8 (9), p.4773-4778

2018

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Thiosemicarbazone@Gold nanoparticle hybrid as selective SERS substrate for Hg2+ ions

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2018-11, Vol.204, p.174-179

2018

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Conformational equilibrium of phenylacetic acid and its halogenated analogues through theoretical studies, NMR and IR spectroscopy

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2017-03, Vol.174, p.138-146

2017

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New 4-methoxy-naphthalene derivatives as promisor antifungal agents for paracoccidioidomycosis treatment

Future microbiology, 2019-02, Vol.14 (3), p.235-245

2019

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The conformational analysis of 2-halocyclooctanones

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2015-02, Vol.137, p.176-184

2015

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Theoretical and experimental investigation of the polyeletrophilic β-enamino diketone: straightforward and highly regioselective synthesis of 1,4,5-trisubstituted pyrazoles and pyrazolo[3,4-d]pyridazinones

RSC advances, 2016-01, Vol.6 (1), p.290-302

2016

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Conformational Analysis of cis-2-Halocyclohexanols; Solvent Effects by NMR and Theoretical Calculations

Journal of organic chemistry, 2011-01, Vol.76 (1), p.145-153

2011

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Structural characterization of dimeric indole alkaloids from Psychotria brachybotrya by NMR spectroscopy and theoretical calculations

Tetrahedron letters, 2016-03, Vol.57 (12), p.1331-1334

2016

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The prediction of 1H chemical shifts in amines: a semiempirical and ab initio investigation

Magnetic resonance in chemistry, 2007-09, Vol.45 (9), p.749-757

2007

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Regiochemical Control of Pyrazoles by Solvent and [beta]-Enamino Diketone Structure: Regioselective Synthesis of 4,5-Disubstituted N-Phenylpyrazoles

Asian journal of organic chemistry, 2017-05, Vol.6 (5), p.627

2017

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Structural Characterization and Biological Evaluation of 18‐Nor‐ent‐labdane Diterpenoids from Grazielia gaudichaudeana

Chemistry & biodiversity, 2019-05, Vol.16 (5), p.e1800644-n/a

2019

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Medium Effect on the Rotational Barrier of N,N,N′-Trimethylurea and N,N,N′-Trimethylthiourea: Experimental and Theoretical Study

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2010-06, Vol.114 (22), p.6423-6430

2010

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NMR Spectroscopy and Theoretical Calculations in the Conformational Analysis of 1‑Methylpyrrolidin-2-one 3‑Halo-derivatives

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2015-03, Vol.119 (10), p.2111-2121

2015

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Rotational isomerism of some chloroacetamides: Theoretical and experimental studies through calculations, infrared and NMR

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2014-08, Vol.129, p.148-156

2014

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Infrared and theoretical calculations in 2-halocycloheptanones conformational analysis

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2012-08, Vol.94, p.277-287

2012

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Medium Effect on the Rotational Barrier of Carbamates and Its Sulfur Congeners

Journal of organic chemistry, 2007-03, Vol.72 (6), p.1901-1911

2007

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Strong hyperconjugative interactions limit solvent and substituent influence on conformational equilibrium: the case of cis -2-halocyclohexylamines

Next-Generation Tags for Fluorine Nuclear Magnetic Resonance: Designing Amplification of Chemical Shift Sensitivity

Novel arylcarbamate-N-acylhydrazones derivatives as promising BuChE inhibitors: Design, synthesis, molecular modeling and biological evaluation

One-Pot Highly Regioselective Synthesis of α‑Ketoamide N‑Arylpyrazoles from Secondary β‑Enamino Diketones

Synthesis and evaluation against Leishmania amazonensis of novel pyrazolo[3,4-d]pyridazinone-N-acylhydrazone-(bi)thiophene hybrids

Synthesis and antifungal activity of new hybrids pyrimido[4,5-d]pyridazinone-N-acylhydrazones

Acidities under the Perspective of Energy Decomposition Analysis

Targeting the Homoserine Dehydrogenase of Paracoccidioides Species for Treatment of Systemic Fungal Infections

Development of methodologies for the regioselective synthesis of four series of regioisomer isoxazoles from β-enamino diketones

Thiosemicarbazone@Gold nanoparticle hybrid as selective SERS substrate for Hg2+ ions

TOCSY, hydrogen decoupling and computational calculations to an unequivocal structural elucidation of a new sesquiterpene derivative and identification of other constituents from Praxelis sanctopaulensis

Conformational equilibrium of phenylacetic acid and its halogenated analogues through theoretical studies, NMR and IR spectroscopy

New 4-methoxy-naphthalene derivatives as promisor antifungal agents for paracoccidioidomycosis treatment

The conformational analysis of 2-halocyclooctanones

Theoretical and experimental investigation of the polyeletrophilic β-enamino diketone: straightforward and highly regioselective synthesis of 1,4,5-trisubstituted pyrazoles and pyrazolo[3,4-d]pyridazinones

Conformational Analysis of cis-2-Halocyclohexanols; Solvent Effects by NMR and Theoretical Calculations

Structural characterization of dimeric indole alkaloids from Psychotria brachybotrya by NMR spectroscopy and theoretical calculations

The prediction of 1H chemical shifts in amines: a semiempirical and ab initio investigation

Regiochemical Control of Pyrazoles by Solvent and [beta]-Enamino Diketone Structure: Regioselective Synthesis of 4,5-Disubstituted N-Phenylpyrazoles

Structural Characterization and Biological Evaluation of 18‐Nor‐ent‐labdane Diterpenoids from Grazielia gaudichaudeana

Medium Effect on the Rotational Barrier of N,N,N′-Trimethylurea and N,N,N′-Trimethylthiourea: Experimental and Theoretical Study

NMR Spectroscopy and Theoretical Calculations in the Conformational Analysis of 1‑Methylpyrrolidin-2-one 3‑Halo-derivatives

Rotational isomerism of some chloroacetamides: Theoretical and experimental studies through calculations, infrared and NMR

Infrared and theoretical calculations in 2-halocycloheptanones conformational analysis

Medium Effect on the Rotational Barrier of Carbamates and Its Sulfur Congeners

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