ArticleChemistry (Weinheim an der Bergstrasse, Germany)2021
Bifunctional Hydrogen Bond Donor-Catalyzed Diels-Alder Reactions: Origin of Stereoselectivity and Rate Enhancement.
Article in Chemistry (Weinheim an der Bergstrasse, Germany), 2021. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 22 papers.
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Who cites it
22 citing papers in PubMed.
- Polarity‑controlled Lewis acid catalysis in the Diels-Alder reaction of cyclopentadiene and acrolein: a DFT and global electron density transfer (GEDT) analysis of BFJournal of molecular modeling · 2026Article
- Hydrogen Bond Benchmark: Focal-Point Analysis and Assessment of DFT Functionals.Journal of computational chemistry · 2025Article
- Transition-state aromaticity and its relationship with reactivity in pericyclic reactions.Beilstein journal of organic chemistry · 2025Article
- Computational Organic Chemistry: The Frontier for Understanding and Designing Bioorthogonal Cycloadditions.Topics in current chemistry (Cham) · 2024Review
- Lewis Acid-Catalyzed Carbonyl-Ene Reaction: Interplay between Aromaticity, Synchronicity, and Pauli Repulsion.The Journal of organic chemistry · 2023Article
- Unravelling the Mechanism and Governing Factors in Lewis Acid and Non-Covalent Diels-Alder Catalysis: Different Perspectives.International journal of molecular sciences · 2023Article
- How Bases Catalyze Diels-Alder Reactions.Chemistry (Weinheim an der Bergstrasse, Germany) · 2023Article
- Combining iminium and supramolecular catalysis for the [4 + 2] cycloaddition ofOrganic & biomolecular chemistry · 2022Article
- How Ionization Catalyzes Diels-Alder Reactions.Chemistry (Weinheim an der Bergstrasse, Germany) · 2022Article
- Origin of Catalysis and Selectivity in Lewis Acid-Promoted Diels-Alder Reactions Involving Vinylazaarenes as Dienophiles.The Journal of organic chemistry · 2022Article
- How the Chalcogen Atom Size Dictates the Hydrogen-Bond Donor Capability of Carboxamides, Thioamides, and Selenoamides.Chemistry (Weinheim an der Bergstrasse, Germany) · 2022Article
- Article
- Strength and Nature of Host-Guest Interactions in Metal-Organic Frameworks from a Quantum-Chemical Perspective.Chemphyschem : a European journal of chemical physics and physical chemistry · 2022Article
- An ETS-NOCV-based computational strategies for the characterization of concerted transition states involving COJournal of computational chemistry · 2022Article
- Hydrogen-Bond-Assisted Diels-Alder Kinetics or Self-Healing in Reversible Polymer Networks? A Combined Experimental and Theoretical Study.Molecules (Basel, Switzerland) · 2022Article
- Origin of asynchronicity in Diels-Alder reactions.Physical chemistry chemical physics : PCCP · 2021Article
- Lewis Acid-Catalyzed Diels-Alder Reactions: Reactivity Trends across the Periodic Table.Chemistry (Weinheim an der Bergstrasse, Germany) · 2021Article
- Chemical reactivity from an activation strain perspective.Chemical communications (Cambridge, England) · 2021Review
- Catalysis by Bidentate Iodine(III)-Based Halogen Donors: Surpassing the Activity of Strong Lewis Acids.The Journal of organic chemistry · 2021Article
- Nature of the Hydrogen Bond Enhanced Halogen Bond.Molecules (Basel, Switzerland) · 2021Article
Corrections and comments
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4 authors.
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Abstract
The selectivity and rate enhancement of bifunctional hydrogen bond donor-catalyzed Diels-Alder reactions between cyclopentadiene and acrolein were quantum chemically studied using density functional theory in combination with coupled-cluster theory. (Thio)ureas render the studied Diels-Alder cycloaddition reactions exo selective and induce a significant acceleration of this process by lowering the reaction barrier by up to 7 kcal mol
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