ROSA M
CLARAMUNT VALLESPI
Ikertzailea 1980-2022 tartean
MARTA
PEREZ TORRALBA
Profesor Titular Universidad
MARTA PEREZ TORRALBA-rekin lankidetzan egindako argitalpenak (30)
2021
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1,5-benzodiazepin-2(3h)-ones: In vitro evaluation as antiparkinsonian agents
Antioxidants, Vol. 10, Núm. 10
2020
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A GIPAW versus GIAO-ZORA-SO study of 13C and 15N CPMAS NMR chemical shifts of aromatic and heterocyclic bromo derivatives
Solid State Nuclear Magnetic Resonance, Vol. 108
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Regiospecific synthesis and structural studies of 3,5-dihydro-4h-pyrido[2,3-b][1,4]diazepin-4-ones and comparison with 1,3-dihydro-2h-benzo[b][1,4]diazepin-2-ones
ACS Omega, pp. 25408-25422
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Weak Intermolecular CH···N Hydrogen Bonding: Determination of 13CH-15N Hydrogen-Bond Mediated J Couplings by Solid-State NMR Spectroscopy and First-Principles Calculations
Journal of Physical Chemistry A, Vol. 124, Núm. 3, pp. 560-572
2018
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The structure of fosfomycin salts in solution and in the solid state by nuclear magnetic resonance spectroscopy and DFT calculations
Tetrahedron, Vol. 74, Núm. 29, pp. 3937-3942
2016
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Static and Dynamic Properties of Fluorinated 4-Aryl-1,5-Benzodiazepinones
ChemistrySelect, Vol. 1, Núm. 4, pp. 861-870
2015
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A theoretical and experimental study of the NMR spectra of 4,5,6,7-tetrafluorobenzazoles with special stress on PCM calculations of chemical shifts
Magnetic Resonance in Chemistry, Vol. 53, Núm. 5, pp. 353-362
2014
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Structural investigation of weak intermolecular interactions (Hydrogen and Halogen Bonds) in fluorine-substituted benzimidazoles
Crystal Growth and Design, Vol. 14, Núm. 7, pp. 3499-3509
2013
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A facile method to determine the absolute structure of achiral molecules: Supramolecular-tilt structures
Chemistry - A European Journal, Vol. 19, Núm. 19, pp. 6044-6051
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Principales compuestos químicos
UNED - Universidad Nacional de Educación a Distancia
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Química bioorgánica y productos naturales
UNED - Universidad Nacional de Educación a Distancia
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Structure of 1,5-benzodiazepinones in the solid state and in solution: Effect of the fluorination in the six-membered ring
Beilstein Journal of Organic Chemistry, Vol. 9, pp. 2156-2167
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Structure of NH-benzazoles (1H-benzimidazoles, 1H- and 2H-indazoles, 1H- and 2H-benzotriazoles)
Chemistry of Heterocyclic Compounds, Vol. 49, Núm. 1, pp. 177-202
2011
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Crystal and molecular structure of three biologically active nitroindazoles
Journal of Molecular Structure, Vol. 985, Núm. 1, pp. 75-81
2010
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15N-15N spin-spin coupling constants through intermolecular hydrogen bonds in the solid state
Journal of Magnetic Resonance, Vol. 206, Núm. 2, pp. 274-279
2008
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NMR studies of ultrafast intramolecular proton tautomerism in crystalline and amorphous N,N′-diphenyl-6-aminofulvene-1-aldimine: Solid-state, kinetic isotope, and tunneling effects
Journal of the American Chemical Society, Vol. 130, Núm. 27, pp. 8620-8632
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Quantifying weak hydrogen bonding in uracil and 4-cyano-4′- ethynylbiphenyl: A combined computational and experimental investigation of NMR chemical shifts in the solid state
Journal of the American Chemical Society, Vol. 130, Núm. 3, pp. 945-954
2007
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Double addition of azoles to glyoxal: Characterization of the bis-adducts and theoretical study of their structure
Arkivoc, Vol. 2007, Núm. 12, pp. 55-66
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Double addition of azoles to glyoxal: Characterization of the bis-adducts and theoretical study of their structure
Arkivoc, Vol. 2007, Núm. 10, pp. 232-244
2004
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On the tautomerism of pyrazolones: The geminal 2J[pyrazole C-4,H-3(5)] spin coupling constant as a diagnostic tool
Tetrahedron, Vol. 60, Núm. 32, pp. 6791-6805