Search Results - "Sordo, José Ángel"

Structure and Spectroscopic Insights for CH3PCO Isomers: A High-Level Quantum Chemical Study by Sanz-Novo, Miguel, Redondo, Pilar, Sánchez, Clara Isabel, Largo, Antonio, Barrientos, Carmen, Sordo, José Ángel

“…The exploration of phosphorus-bearing species stands as a prolific field in current astrochemical research, particularly within the context of prebiotic…”
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Desulfinylation of Prop-2-enesulfinic Acid: Experimental Results and Mechanistic Theoretical Analysis by Varela-Álvarez, Adrián, Marković, Dean, Vogel, Pierre, Sordo, José Ángel

“…The potential energy surfaces of the desulfinylation of prop-2-enesulfinic acid (13) in CH2Cl2 solution at −15 °C have been explored by quantum calculations…”
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Kinetics Studies of the Reactions of Main Fourth-Period Monocations (Ga+, Ge+, As+, and Se+) with Methyl Fluoride by Barrientos, Carmen, Rayón, Víctor Manuel, Largo, Antonio, Sordo, José Ángel, Redondo, Pilar

“…Thermodynamics and kinetics theoretical studies on the gas-phase reactions of fluoromethane with main fourth-period monocations (Ga+, Ge+, As+, and Se+) have…”
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Quantum calculations on the acid catalyzed rearrangements of norborn-5-en-2-one, 7-oxanorborn-5-en-2-one and 7-azanorborn-5-en-2-one The electron-releasing effect of homoconjugated carbonyl group by SORDO, José Angel, VARELA-ALVAREZ, Adrian, GIANI, Samuele, VOGEL, Pierre

“…Protonation of norborn-5-en-2-one gives 6-oxo-2-norbornyl cation (2) as most stable C7H9O+ cation. Quantum calculations at B3LYP/6-31G(d) level (gas phase,…”
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Expeditious Asymmetric Synthesis of Polypropionates Relying on Sulfur Dioxide-Induced C–C Bond Forming Reactions by Pierre Vogel, José Angel Sordo Gonzalo

“…For a long time, the organic chemistry of sulfur dioxide (SO2) consisted of sulfinates that react with carbon electrophiles to generate sulfones. With alkenes…”
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New Organic Chemistry of Sulfur Dioxide by Vogel, Pierre, Turks, Ma̅ris, Bouchez, Laure, Marković, Dean, Varela-Álvarez, Adrián, Sordo, José Ángel

“…Simple 1,3-dienes undergo highly stereoselective hetero-Diels–Alder additions with SO2 at low temperature giving sultines. These reactions that are faster than…”
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Theoretical study of the C–F bond activation in methyl fluoride by alkaline-earth metal monocations by Varela-Álvarez, Adrián, Sordo, José Ángel, Redondo, Pilar, Largo, Antonio, Barrientos, Carmen, Rayón, Víctor M.

“…Reactions of methyl fluoride with bare alkaline-earth metal monocations (Mg + , Ca + , Sr + , and Ba + ) were studied using theoretical methods. Thermochemical…”
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Mechanism of the Diphenyldisulfone-Catalyzed Isomerization of Alkenes. Origin of the Chemoselectivity:  Experimental and Quantum Chemistry Studies by Marković, Dean, Varela-Álvarez, Adrián, Sordo, José Angel, Vogel, Pierre

“…Polysulfone- and diphenyldisulfone-catalyzed alkene isomerizations are much faster for 2-alkyl-1-alkenes than for linear, terminal alkenes. The mechanism of…”
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Structure and Spectroscopic Insights for CH 3 PCO Isomers: A High-Level Quantum Chemical Study by Sanz-Novo, Miguel, Redondo, Pilar, Sánchez, Clara Isabel, Largo, Antonio, Barrientos, Carmen, Sordo, José Ángel

“…The exploration of phosphorus-bearing species stands as a prolific field in current astrochemical research, particularly within the context of prebiotic…”
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Recent Advances in the Synthesis of Five-Membered Cyclic Carbonates and Carbamates from Allylic or Propargylic Substrates and CO2 by Filip Vranješević, Maria Kolympadi Markovic, Dario Matulja, Gabriela Ambrožić, José Ángel Sordo, Sylvain Laclef, Valerije Vrček, Dean Marković

“…The organic carbamates and carbonates are highly desirable compounds that have found a wide range of applications in drug design, medicinal chemistry, material…”
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Hetero-Diels-Alder and Cheletropic Additions of Sulfur Dioxide to 1,2-Dimethylidenecycloalkanes. Determination of Thermochemical and Kinetics Parameters for Reactions in Solution and Comparison with Estimates From Quantum Calculations by Monnat, Frédéric, Vogel, Pierre, Sordo, José Ángel

“…Below −60° and without catalyst, 1,2‐dimethylidenecyclopentane (16), 1,2‐dimethylidenecyclohexane (13), 1,2‐dimethylidenecycloheptane (17), and…”
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Reactivity of First-Row Transition Metal Monocations (Sc+, Ti+, V+, Zn+) with Methyl Fluoride: A Computational Study by Redondo, Pilar, Varela-Álvarez, Adrián, Rayón, Víctor Manuel, Largo, Antonio, Sordo, José Ángel, Barrientos, Carmen

“…The gas-phase reactivity of methyl fluoride with selected first-row transition metal monocations (Sc+, Ti+, V+, and Zn+) has been theoretically investigated…”
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Quantum calculations on the acid catalyzed rearrangements of norborn-5-en-2-one, 7-oxanorborn-5-en-2-one and 7-azanorborn-5-en-2-oneThe electron-releasing effect of homoconjugated carbonyl group by Sordo, José Ángel, Varela-Álvarez, Adrián, Giani, Samuele, Vogel, Pierre

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Quantum calculations on the acid catalyzed rearrangements of norborn-5-en-2-one, 7-oxanorborn-5-en-2-one and 7-azanorborn-5-en-2-one by Sordo, José Ángel, Varela-Álvarez, Adrián, Giani, Samuele, Vogel, Pierre

“…Protonation of norborn-5-en-2-one gives 6-oxo-2-norbornyl cation (2) as most stable C 7H 9O + cation. Quantum calculations at B3LYP/6-31G(d) level (gas phase,…”
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Dedication by Rico, Jaime Fernández, de la vega, José Manuel García, Sordo, José Ángel

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Kinetics Studies of the Reactions of Main Fourth-Period Monocations (Ga super(+), Ge super(+), As super(+), and Se super(+)) with Methyl Fluoride by Barrientos, Carmen, Rayon, Victor Manuel, Largo, Antonio, Sordo, Jose Angel, Redondo, Pilar

“…Thermodynamics and kinetics theoretical studies on the gas-phase reactions of fluoromethane with main fourth-period monocations (Ga super(+), Ge super(+), As…”
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Reactivity of First-Row Transition Metal Monocations (Sc super(+), Ti super(+), V super(+), Zn super(+)) with Methyl Fluoride: A Computational Study by Redondo, Pilar, Varela-Alvarez, Adrian, Rayon, Victor Manuel, Largo, Antonio, Sordo, Jose Angel, Barrientos, Carmen

“…The gas-phase reactivity of methyl fluoride with selected first-row transition metal monocations (Sc super(+), Ti super(+), V super(+), and Zn super(+)) has…”
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