Year |
Citation |
Score |
2024 |
Beutick SE, Yu S, Orian L, Bickelhaupt FM, Hamlin TA. Retro-Cope elimination of cyclic alkynes: reactivity trends and rational design of next-generation bioorthogonal reagents. Chemical Science. PMID 39239482 DOI: 10.1039/d4sc04211e |
0.817 |
|
2024 |
Pulcinella A, Tiwari PC, Luridiana A, Yamazaki K, Mazzarella D, Sadhoe AK, Alfano AI, Tiekink EH, Hamlin TA, Noel T. C1-4 Alkylation of Aryl Bromides with Light Alkanes enabled by Metallaphotocatalysis in Flow. Angewandte Chemie (International Ed. in English). e202413846. PMID 39192732 DOI: 10.1002/anie.202413846 |
0.351 |
|
2024 |
Tiekink EH, Vermeeren P, Hamlin TA. Correction: Not antiaromaticity gain, but increased asynchronicity enhances the Diels-Alder reactivity of tropone. Chemical Communications (Cambridge, England). PMID 38605667 DOI: 10.1039/d4cc90104e |
0.787 |
|
2024 |
Vermeeren P, Dalla Tiezza M, Wolf ME, Lahm ME, Allen WD, Schaefer HF, Hamlin TA, Bickelhaupt FM. Correction: Pericyclic reaction benchmarks: hierarchical computations targeting CCSDT(Q)/CBS and analysis of DFT performance. Physical Chemistry Chemical Physics : Pccp. PMID 38436412 DOI: 10.1039/d4cp90047b |
0.791 |
|
2024 |
Rodrigues Silva D, Blokker E, van der Schuur JM, Hamlin TA, Bickelhaupt FM. Nature and strength of group-14 A-A' bonds. Chemical Science. 15: 1648-1656. PMID 38303946 DOI: 10.1039/d3sc06215e |
0.768 |
|
2023 |
Staronova L, Yamazaki K, Xu X, Shi H, Bickelhaupt FM, Hamlin TA, Dixon DJ. Cobalt-Catalyzed Enantio- and Regioselective C(sp3)-H Alkenylation of Thioamides. Angewandte Chemie (International Ed. in English). e202316021. PMID 38143241 DOI: 10.1002/anie.202316021 |
0.722 |
|
2023 |
Poater J, Vermeeren P, Hamlin TA, Bickelhaupt FM, Solà M. On the existence of collective interactions reinforcing the metal-ligand bond in organometallic compounds. Nature Communications. 14: 3872. PMID 37400461 DOI: 10.1038/s41467-023-39498-y |
0.773 |
|
2023 |
Hansen T, Vermeeren P, Zijderveld KWJ, Bickelhaupt FM, Hamlin TA. SN2 versus E2 Competition of Cyclic Ethers. Chemistry (Weinheim An Der Bergstrasse, Germany). e202301308. PMID 37338310 DOI: 10.1002/chem.202301308 |
0.819 |
|
2023 |
Su G, Formica M, Yamazaki K, Hamlin TA, Dixon DJ. Catalytic Enantioselective Intramolecular Oxa-Michael Reaction to α,β-Unsaturated Esters and Amides. Journal of the American Chemical Society. PMID 37253087 DOI: 10.1021/jacs.3c03182 |
0.675 |
|
2023 |
Tiekink EH, Vermeeren P, Hamlin TA. The Origin of Catalysis and Regioselectivity of Lewis Acid-Catalyzed Diels-Alder Reactions with Tropone. Chemistry (Weinheim An Der Bergstrasse, Germany). e202301223. PMID 37078400 DOI: 10.1002/chem.202301223 |
0.829 |
|
2023 |
Tiekink EH, Vermeeren P, Hamlin TA. Not antiaromaticity gain, but increased asynchronicity enhances the Diels-Alder reactivity of tropone. Chemical Communications (Cambridge, England). 59: 3703-3706. PMID 36880301 DOI: 10.1039/d3cc00512g |
0.799 |
|
2023 |
Kučera R, Ellis SR, Yamazaki K, Hayward Cooke J, Chekshin N, Christensen KE, Hamlin TA, Dixon DJ. Enantioselective Total Synthesis of (-)-Himalensine A via a Palladium and 4-Hydroxyproline Co-catalyzed Desymmetrization of Vinyl-bromide-tethered Cyclohexanones. Journal of the American Chemical Society. 145: 5422-5430. PMID 36820616 DOI: 10.1021/jacs.2c13710 |
0.673 |
|
2022 |
Remmerswaal WA, Hansen T, Hamlin T, Codée JDC. Origin of Stereoselectivity in SE2' Reactions of Six-membered Ring Oxocarbenium Ions. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 36511875 DOI: 10.1002/chem.202203490 |
0.624 |
|
2022 |
de Azevedo Santos L, C Ramalho T, Hamlin TA, Bickelhaupt FM. Intermolecular Covalent Interactions: Nature and Directionality. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 36478415 DOI: 10.1002/chem.202203791 |
0.694 |
|
2022 |
Yu S, Tiekink EH, Vermeeren P, Bickelhaupt FM, Hamlin TA. How Bases Catalyze Diels-Alder Reactions. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 36330879 DOI: 10.1002/chem.202203121 |
0.834 |
|
2022 |
Hansen T, Vermeeren P, Bickelhaupt FM, Hamlin TA. Stability of alkyl carbocations. Chemical Communications (Cambridge, England). 58: 12050-12053. PMID 36254748 DOI: 10.1039/d2cc04034d |
0.791 |
|
2022 |
Hansen T, Nin-Hill A, Codée JDC, Hamlin TA, Rovira C. Rational Tuning of the Reactivity of Three-Membered Heterocycle Ring-Openings via SN2 Reactions. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 35896443 DOI: 10.1002/chem.202201649 |
0.737 |
|
2022 |
Vermeeren P, Dalla Tiezza M, Wolf ME, Lahm ME, Allen WD, Schaefer HF, Hamlin TA, Bickelhaupt FM. Pericyclic reaction benchmarks: hierarchical computations targeting CCSDT(Q)/CBS and analysis of DFT performance. Physical Chemistry Chemical Physics : Pccp. 24: 18028-18042. PMID 35861164 DOI: 10.1039/d2cp02234f |
0.816 |
|
2022 |
Beutick SE, Vermeeren P, Hamlin TA. The 1,3-Dipolar Cycloaddition: From Conception to Quantum Chemical Design. Chemistry, An Asian Journal. e202200553. PMID 35822651 DOI: 10.1002/asia.202200553 |
0.815 |
|
2022 |
Blokker E, van Zeist WJ, Sun X, Poater J, van der Schuur JM, Hamlin TA, Bickelhaupt FM. Methyl Substitution Destabilizes Alkyl Radicals. Angewandte Chemie (International Ed. in English). PMID 35819818 DOI: 10.1002/anie.202207477 |
0.769 |
|
2022 |
Hansen T, Vermeeren P, de Jong L, Bickelhaupt FM, Hamlin TA. S2 versus S2' Competition. The Journal of Organic Chemistry. PMID 35748807 DOI: 10.1021/acs.joc.2c00527 |
0.805 |
|
2022 |
Vermeeren P, Hamlin TA, Bickelhaupt FM. How Ionization Catalyzes Diels-Alder Reactions. Chemistry (Weinheim An Der Bergstrasse, Germany). e202201620. PMID 35723189 DOI: 10.1002/chem.202201620 |
0.824 |
|
2022 |
Vermeeren P, Hamlin TA, Bickelhaupt FM. How Ionization Catalyzes Diels-Alder Reactions. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 35442551 DOI: 10.1002/chem.202200987 |
0.846 |
|
2022 |
Hansen T, Sun X, Tiezza MD, van Zeist WJ, van Stralen JNP, Geerke DP, Wolters LP, Poater J, Hamlin TA, Bickelhaupt FM. C-X Bond Activation by Palladium: Steric Shielding versus Steric Attraction. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 35420229 DOI: 10.1002/chem.202201093 |
0.771 |
|
2022 |
Svatunek D, Houszka N, Hamlin TA, Bickelhaupt FM, Mikula H. Corrigendum: Chemoselectivity of Tertiary Azides in Strain-Promoted Alkyne-Azide Cycloadditions. Chemistry (Weinheim An Der Bergstrasse, Germany). 28: e202200414. PMID 35285565 DOI: 10.1002/chem.202200414 |
0.772 |
|
2022 |
Sun X, Hansen T, Poater J, Hamlin TA, Bickelhaupt FM. Rational design of iron catalysts for C-X bond activation. Journal of Computational Chemistry. PMID 35137432 DOI: 10.1002/jcc.26818 |
0.814 |
|
2022 |
Nieuwland C, Hamlin TA, Fonseca Guerra C, Barone G, Bickelhaupt FM. B-DNA Structure and Stability: The Role of Nucleotide Composition and Order. Chemistryopen. 11: e202200013. PMID 35103418 DOI: 10.1002/open.202200013 |
0.651 |
|
2022 |
Nieuwland C, Hamlin TA, Fonseca Guerra C, Barone G, Bickelhaupt FM. B-DNA Structure and Stability: The Role of Nucleotide Composition and Order. Chemistryopen. 11: e202100231. PMID 35083880 DOI: 10.1002/open.202100231 |
0.653 |
|
2022 |
Shiomi S, Shennan BDA, Yamazaki K, Fuentes de Arriba ÁL, Vasu D, Hamlin TA, Dixon DJ. A New Organocatalytic Desymmetrization Reaction Enables the Enantioselective Total Synthesis of Madangamine E. Journal of the American Chemical Society. PMID 35037758 DOI: 10.1021/jacs.1c12040 |
0.666 |
|
2022 |
Rozsar D, Formica M, Yamazaki K, Hamlin TA, Dixon DJ. Bifunctional Iminophosphorane-Catalyzed Enantioselective Sulfa-Michael Addition to Unactivated α,β-Unsaturated Amides. Journal of the American Chemical Society. PMID 34990142 DOI: 10.1021/jacs.1c11898 |
0.618 |
|
2021 |
Hansen T, Sun X, Dalla Tiezza M, van Zeist WJ, Poater J, Hamlin TA, Bickelhaupt FM. C(spn)-X (n = 1-3) Bond Activation by Palladium. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 34958486 DOI: 10.1002/chem.202103953 |
0.797 |
|
2021 |
Hansen T, Roozee JC, Bickelhaupt FM, Hamlin TA. How Solvation Influences the S2 versus E2 Competition. The Journal of Organic Chemistry. PMID 34932346 DOI: 10.1021/acs.joc.1c02354 |
0.741 |
|
2021 |
Blokker E, Sun X, Poater J, van der Schuur JM, Hamlin TA, Bickelhaupt FM. The Chemical Bond: When Atom Size Instead of Electronegativity Difference Determines Trend in Bond Strength. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 34609774 DOI: 10.1002/chem.202103544 |
0.785 |
|
2021 |
Tiezza MD, Hamlin TA, Bickelhaupt FM, Orian L. Radical Scavenging Potential of the Phenothiazine Scaffold A Computational Analysis. Chemmedchem. PMID 34536069 DOI: 10.1002/cmdc.202100546 |
0.797 |
|
2021 |
Rodrigues Silva D, de Azevedo Santos L, Hamlin TA, Bickelhaupt FM, P Freitas M, Fonseca Guerra C. Dipolar repulsion in α-halocarbonyl compounds revisited. Physical Chemistry Chemical Physics : Pccp. PMID 34528039 DOI: 10.1039/d1cp02502c |
0.686 |
|
2021 |
Vermeeren P, Hamlin TA, Bickelhaupt FM. Origin of asynchronicity in Diels-Alder reactions. Physical Chemistry Chemical Physics : Pccp. PMID 34499069 DOI: 10.1039/d1cp02456f |
0.842 |
|
2021 |
Maitland JAP, Leitch JA, Yamazaki K, Christensen KE, Cassar DJ, Hamlin TA, Dixon DJ. Switchable, Reagent-Controlled Diastereodivergent Photocatalytic Carbocyclisation of Imine-Derived α-Amino Radicals. Angewandte Chemie (International Ed. in English). PMID 34449968 DOI: 10.1002/anie.202107253 |
0.642 |
|
2021 |
Yu S, Bickelhaupt FM, Hamlin TA. Switch From Pauli-Lowering to LUMO-Lowering Catalysis in Brønsted Acid-Catalyzed Aza-Diels-Alder Reactions. Chemistryopen. 10: 784-789. PMID 34351072 DOI: 10.1002/open.202100172 |
0.835 |
|
2021 |
Yamazaki K, Gabriel P, Di Carmine G, Pedroni J, Farizyan M, Hamlin TA, Dixon DJ. General Pyrrolidine Synthesis via Iridium-Catalyzed Reductive Azomethine Ylide Generation from Tertiary Amides and Lactams. Acs Catalysis. 11: 7489-7497. PMID 34306810 DOI: 10.1021/acscatal.1c01589 |
0.699 |
|
2021 |
Vermeeren P, Doppert MT, Bickelhaupt FM, Hamlin TA. How metallylenes activate small molecules. Chemical Science. 12: 4526-4535. PMID 34163718 DOI: 10.1039/d0sc05987k |
0.814 |
|
2021 |
de Azevedo Santos L, Hamlin TA, Ramalho TC, Bickelhaupt FM. The pnictogen bond: a quantitative molecular orbital picture. Physical Chemistry Chemical Physics : Pccp. 23: 13842-13852. PMID 34155488 DOI: 10.1039/d1cp01571k |
0.69 |
|
2021 |
Hamlin TA, Hansen T, Vermeeren P, Bickelhaupt FM. Origin of the α-Effect in SN2 Reactions. Angewandte Chemie (International Ed. in English). PMID 34087047 DOI: 10.1002/anie.202106053 |
0.797 |
|
2021 |
Vermeeren P, Hamlin TA, Bickelhaupt FM. Chemical reactivity from an activation strain perspective. Chemical Communications (Cambridge, England). PMID 34075969 DOI: 10.1039/d1cc02042k |
0.831 |
|
2021 |
Su G, Thomson CJ, Yamazaki K, Rozsar D, Christensen KE, Hamlin TA, Dixon DJ. A bifunctional iminophosphorane squaramide catalyzed enantioselective synthesis of hydroquinazolines intramolecular aza-Michael reaction to α,β-unsaturated esters. Chemical Science. 12: 6064-6072. PMID 33996002 DOI: 10.1039/d1sc00856k |
0.666 |
|
2021 |
Hamlin TA, Vermeeren P, Dalla Tiezza M, van Dongen M, Fernández I, Bickelhaupt FM. Lewis Acid-Catalyzed Diels-Alder Reactions: Reactivity Trends Across the Periodic Table. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 33780068 DOI: 10.1002/chem.202100522 |
0.845 |
|
2021 |
Hamlin TA, Bickelhaupt FM, Fernández I. The Pauli Repulsion-Lowering Concept in Catalysis. Accounts of Chemical Research. PMID 33759502 DOI: 10.1021/acs.accounts.1c00016 |
0.746 |
|
2021 |
Svatunek D, Hansen T, Houk KN, Hamlin TA. How the Lewis Base F Catalyzes the 1,3-Dipolar Cycloaddition between Carbon Dioxide and Nitrilimines. The Journal of Organic Chemistry. PMID 33577314 DOI: 10.1021/acs.joc.0c02963 |
0.724 |
|
2021 |
Rodrigues Silva D, de Azevedo Santos L, Hamlin TA, Fonseca Guerra C, Freitas MP, Bickelhaupt FM. The Gauche Effect in XCH2CH2X Revisited. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. PMID 33555663 DOI: 10.1002/cphc.202100090 |
0.668 |
|
2021 |
de Azevedo Santos L, Ramalho TC, Hamlin TA, Bickelhaupt FM. Chalcogen bonds: Hierarchical ab initio benchmark and density functional theory performance study. Journal of Computational Chemistry. PMID 33543482 DOI: 10.1002/jcc.26489 |
0.679 |
|
2021 |
Hansen T, Vermeeren P, Yoshisada R, Filippov DV, van der Marel GA, Codée JDC, Hamlin TA. How Lewis Acids Catalyze Ring-Openings of Cyclohexene Oxide. The Journal of Organic Chemistry. PMID 33538169 DOI: 10.1021/acs.joc.0c02955 |
0.835 |
|
2021 |
Vermeeren P, van Zeist WJ, Hamlin TA, Fonseca Guerra C, Bickelhaupt FM. Not Carbon s-p Hybridization, but Coordination Number Determines C-H and C-C Bond Length. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 33513281 DOI: 10.1002/chem.202004653 |
0.795 |
|
2021 |
Yu S, Vermeeren P, Hamlin TA, Bickelhaupt FM. Cover Feature: How Oriented External Electric Fields Modulate Reactivity (Chem. Eur. J. 18/2021) Chemistry – a European Journal. 27: 5575-5575. DOI: 10.1002/CHEM.202100126 |
0.428 |
|
2021 |
Vermeeren P, Hamlin TA, Bickelhaupt FM, Fernández I. Cover Feature: Bifunctional Hydrogen Bond Donor‐Catalyzed Diels–Alder Reactions: Origin of Stereoselectivity and Rate Enhancement (Chem. Eur. J. 16/2021) Chemistry – a European Journal. 27: 5054-5054. DOI: 10.1002/CHEM.202005344 |
0.307 |
|
2020 |
Zhang L, Yamazaki K, Leitch JA, Manzano R, Atkinson VAM, Hamlin TA, Dixon DJ. Dual catalytic enantioselective desymmetrization of allene-tethered cyclohexanones. Chemical Science. 11: 7444-7450. PMID 34123026 DOI: 10.1039/d0sc02878a |
0.613 |
|
2020 |
Vermeeren P, Hamlin TA, Fernández I, Bickelhaupt FM. Origin of rate enhancement and asynchronicity in iminium catalyzed Diels-Alder reactions. Chemical Science. 11: 8105-8112. PMID 34094173 DOI: 10.1039/d0sc02901g |
0.841 |
|
2020 |
Yu S, Vermeeren P, Hamlin TA, Bickelhaupt FM. How Oriented External Electric Fields Modulate Reactivity. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 33289179 DOI: 10.1002/chem.202004906 |
0.829 |
|
2020 |
Vermeeren P, Hamlin TA, Bickelhaupt FM, Fernández I. Bifunctional Hydrogen Bond Donor-Catalyzed Diels-Alder Reactions: Origin of Stereoselectivity and Rate Enhancement. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 33169912 DOI: 10.1002/chem.202004496 |
0.849 |
|
2020 |
Vermeeren P, Hansen T, Grasser M, Silva DR, Hamlin TA, Bickelhaupt FM. S2 versus E2 Competition of F and PH Revisited. The Journal of Organic Chemistry. PMID 33079542 DOI: 10.1021/acs.joc.0c02112 |
0.782 |
|
2020 |
Vermeeren P, Hansen T, Jansen P, Swart M, Hamlin TA, Bickelhaupt FM. A Unified Framework for Understanding Nucleophilicity and Protophilicity in the SN2/E2 Competition. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 32866336 DOI: 10.1002/Chem.202003831 |
0.83 |
|
2020 |
Faltracco M, Sukowski V, van Druenen M, Hamlin TA, Bickelhaupt FM, Ruijter E. Diastereoselective Synthesis of β-Lactams by Ligand-Controlled Stereodivergent Intramolecular Tsuji-Trost Allylation. The Journal of Organic Chemistry. PMID 32584576 DOI: 10.1021/Acs.Joc.0C00575 |
0.716 |
|
2020 |
Yu S, Vermeeren P, van Dommelen K, Bickelhaupt M, Hamlin TA. Understanding the 1,3-Dipolar Cycloadditions of Allenes. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 32220086 DOI: 10.1002/Chem.202000857 |
0.834 |
|
2020 |
Narsaria AK, Ruijter JD, Hamlin TA, Ehlers AW, Guerra CF, Lammertsma K, Bickelhaupt FM. Performance of TDDFT Vertical Excitation Energies of Core-Substituted Naphthalene Diimides. Journal of Computational Chemistry. PMID 32142173 DOI: 10.1002/Jcc.26188 |
0.781 |
|
2020 |
Vermeeren P, Brinkhuis F, Hamlin TA, Bickelhaupt M. How Alkali Cations Catalyze Aromatic Diels-Alder Reactions. Chemistry, An Asian Journal. PMID 32012430 DOI: 10.1002/Asia.202000009 |
0.85 |
|
2020 |
Bettens T, Alonso M, De Proft F, Hamlin TA, Bickelhaupt FM. Ambident Nucleophilic Substitution: Understanding Non-HSAB Behavior through Activation Strain and Conceptual DFT Analyses. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 31957943 DOI: 10.1002/Chem.202000272 |
0.735 |
|
2020 |
Vermeeren P, Hamlin TA, Fernández I, Bickelhaupt FM. How Lewis Acids Catalyze Diels-Alder Reactions. Angewandte Chemie (International Ed. in English). PMID 31944503 DOI: 10.1002/Anie.201914582 |
0.844 |
|
2020 |
Vermeeren P, van der Lubbe SCC, Fonseca Guerra C, Bickelhaupt FM, Hamlin TA. Understanding chemical reactivity using the activation strain model. Nature Protocols. PMID 31925400 DOI: 10.1038/S41596-019-0265-0 |
0.82 |
|
2020 |
Vermeeren P, Hamlin TA, Fernández I, Bickelhaupt FM. Origin of rate enhancement and asynchronicity in iminium catalyzed Diels–Alder reactions Chemical Science. 11: 8105-8112. DOI: 10.1039/D0Sc02901G |
0.84 |
|
2020 |
Zhang L, Yamazaki K, Leitch JA, Manzano R, Atkinson VAM, Hamlin TA, Dixon DJ. Dual catalytic enantioselective desymmetrization of allene-tethered cyclohexanones Chemical Science. 11: 7444-7450. DOI: 10.1039/D0Sc02878A |
0.337 |
|
2020 |
Hansen T, Vermeeren P, Haim A, van Dorp MJH, Codée JDC, Bickelhaupt FM, Hamlin TA. Regioselectivity of Epoxide Ring-Openings via SN
2 Reactions Under Basic and Acidic Conditions European Journal of Organic Chemistry. 2020: 3822-3828. DOI: 10.1002/Ejoc.202000590 |
0.839 |
|
2020 |
Vermeeren P, Hansen T, Jansen P, Swart M, Hamlin TA, Bickelhaupt FM. Cover Feature: A Unified Framework for Understanding Nucleophilicity and Protophilicity in the S
N
2/E2 Competition (Chem. Eur. J. 67/2020) Chemistry – a European Journal. 26: 15341-15341. DOI: 10.1002/chem.202004183 |
0.465 |
|
2019 |
Narsaria AK, Poater J, Fonseca Guerra C, Ehlers AW, Hamlin TA, Lammertsma K, Bickelhaupt FM. Distortion-Controlled Red-Shift of Organic Dye Molecules. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 31815315 DOI: 10.1002/Chem.201905355 |
0.778 |
|
2019 |
Sergeieva T, Hamlin TA, Okovytyy S, Breit B, Bickelhaupt FM. Ligand-Mediated Regioselective Rhodium Catalyzed Benzotriazole-Allene Coupling: Mechanistic Exploration and Quantum Chemical Analysis. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 31778591 DOI: 10.1002/Chem.201905359 |
0.718 |
|
2019 |
Bera T, Singh B, Hamlin TA, Sahoo SC, Saha J. One-Step Assembly of Functionalized Morpholinones and 1,4-Oxazepane-3-ones via [3+3]- and [3+4]-Annulation of Aza-oxyallyl Cation and Amphoteric Compounds. The Journal of Organic Chemistry. PMID 31702149 DOI: 10.1021/Acs.Joc.9B02269 |
0.331 |
|
2019 |
van der Ham A, Hansen T, Lodder G, Codée JDC, Hamlin TA, Filippov D. Computational and NMR Studies on the Complexation of Lithium Ion to 8-Crown-4. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. PMID 31282054 DOI: 10.1002/Cphc.201900496 |
0.527 |
|
2019 |
Sun X, Soini TM, Poater J, Hamlin TA, Bickelhaupt FM. PyFrag 2019-Automating the exploration and analysis of reaction mechanisms. Journal of Computational Chemistry. PMID 31165500 DOI: 10.1002/Jcc.25871 |
0.804 |
|
2019 |
Singh K, Pramanik S, Hamlin TA, Mondal B, Das D, Saha J. Lewis acid catalyzed annulation of spirocyclic donor-acceptor cyclopropanes with exo-heterocyclic olefins: access to highly functionalized bis-spirocyclopentane oxindole frameworks. Chemical Communications (Cambridge, England). PMID 31147663 DOI: 10.1039/C9Cc03393A |
0.347 |
|
2019 |
Narsaria AK, Hamlin TA, Lammertsma K, Bickelhaupt FM. Dual Activation of Aromatic Diels-Alder Reactions. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 31111976 DOI: 10.1002/Chem.201901617 |
0.828 |
|
2019 |
Hamlin TA, Fernández I, Bickelhaupt FM. How Dihalogens Catalyze Michael Addition Reactions. Angewandte Chemie (International Ed. in English). PMID 31033118 DOI: 10.1002/Anie.201903196 |
0.761 |
|
2019 |
Sun X, J Rocha MV, Hamlin TA, Poater J, Bickelhaupt FM. Understanding the differences between iron and palladium in cross-coupling reactions. Physical Chemistry Chemical Physics : Pccp. PMID 30847454 DOI: 10.1039/C8Cp07671E |
0.783 |
|
2019 |
Hamlin TA, Levandowski BJ, Narsaria AK, Houk KN, Bickelhaupt FM. Structural Distortion of Cycloalkynes Influences Cycloaddition Rates Both By Strain and Interaction Energies. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 30779472 DOI: 10.1002/Chem.201900295 |
0.814 |
|
2019 |
Levandowski BJ, Hamlin TA, Eckvahl HJ, Bickelhaupt FM, Houk KN. Diels-Alder reactivities of cycloalkenediones with tetrazine. Journal of Molecular Modeling. 25: 33. PMID 30627945 DOI: 10.1007/S00894-018-3909-Z |
0.736 |
|
2019 |
van Beek B, van Bochove MA, Hamlin TA, Bickelhaupt FM. Nucleophilic substitution at di- and triphosphates: leaving group ability of phosphate versus diphosphate Electronic Structure. 1: 024001. DOI: 10.1088/2516-1075/AB0AF3 |
0.637 |
|
2019 |
Narsaria AK, Hamlin TA, Lammertsma K, Bickelhaupt FM. Cover Feature: Dual Activation of Aromatic Diels–Alder Reactions (Chem. Eur. J. 42/2019) Chemistry – a European Journal. 25: 9782-9782. DOI: 10.1002/Chem.201902538 |
0.817 |
|
2019 |
Hamlin TA, Levandowski BJ, Narsaria AK, Houk KN, Bickelhaupt FM. Cover Feature: Structural Distortion of Cycloalkynes Influences Cycloaddition Rates both by Strain and Interaction Energies (Chem. Eur. J. 25/2019) Chemistry – a European Journal. 25: 6249-6249. DOI: 10.1002/Chem.201900867 |
0.781 |
|
2019 |
Hamlin TA, Fernández I, Bickelhaupt FM. Wie Dihalogene Michael‐Additionsreaktionen katalysieren Angewandte Chemie. 131: 9015-9020. DOI: 10.1002/Ange.201903196 |
0.635 |
|
2018 |
Yu S, de Bruijn HM, Svatunek D, Hamlin TA, Bickelhaupt FM. Factors Controlling the Diels-Alder Reactivity of Hetero-1,3-Butadienes. Chemistryopen. 7: 995-1004. PMID 30524925 DOI: 10.1002/Open.201800193 |
0.822 |
|
2018 |
Bortoli M, Ahmad SM, Hamlin TA, Bickelhaupt FM, Orian L. Nature and strength of chalcogen-π bonds. Physical Chemistry Chemical Physics : Pccp. PMID 30371693 DOI: 10.1039/C8Cp05922E |
0.806 |
|
2018 |
Svatunek D, Houszka N, Hamlin T, Bickelhaupt M, Mikula H. Chemoselectivity of Tertiary Azides in Strain-Promoted Alkyne-Azide Cycloadditions. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 30347481 DOI: 10.1002/Chem.201805215 |
0.738 |
|
2018 |
Hamlin TA, Swart M, Bickelhaupt FM. Nucleophilic Substitution (SN2): Dependence on Nucleophile, Leaving Group, Central Atom, Substituents, and Solvent. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. PMID 29542853 DOI: 10.1002/Cphc.201701363 |
0.706 |
|
2018 |
van Bochove MA, Roos G, Fonseca Guerra C, Hamlin TA, Bickelhaupt FM. How Mgions lower the S2@P barrier in enzymatic triphosphate hydrolysis. Chemical Communications (Cambridge, England). PMID 29537051 DOI: 10.1039/C8Cc00700D |
0.712 |
|
2018 |
Levandowski BJ, Hamlin TA, Helgeson RC, Bickelhaupt FM, Houk KN. Origins of the Endo and Exo Selectivities in Cyclopropenone, Iminocyclopropene, and Triafulvene Diels-Alder Cycloadditions. The Journal of Organic Chemistry. PMID 29470085 DOI: 10.1021/Acs.Joc.8B00025 |
0.76 |
|
2018 |
Hamlin TA, van Beek B, Wolters LP, Bickelhaupt FM. Nucleophilic Substitution in Solution: Activation Strain Analysis of Weak and Strong Solvent Effects. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 29457865 DOI: 10.1002/Chem.201706075 |
0.834 |
|
2018 |
Riesco-Domínguez A, van de Wiel J, Hamlin TA, van Beek B, Lindell SD, Blanco-Ania D, Bickelhaupt FM, Rutjes FPJT. (Trifluoromethyl) Vinyl Sulfide: a Building Block for the Synthesis of CF3S-Containing Isoxazolidines. The Journal of Organic Chemistry. PMID 29320179 DOI: 10.1021/Acs.Joc.7B02639 |
0.694 |
|
2018 |
Miller SA, van Beek B, Hamlin TA, Bickelhaupt FM, Leadbeater NE. A methodology for the photocatalyzed radical trifluoromethylation of indoles: A combined experimental and computational study Journal of Fluorine Chemistry. 214: 94-100. DOI: 10.1016/J.Jfluchem.2018.08.005 |
0.82 |
|
2018 |
Hamlin TA, Svatunek D, Yu S, Ridder L, Infante I, Visscher L, Bickelhaupt FM. Elucidating the Trends in Reactivity of Aza-1,3-Dipolar Cycloadditions European Journal of Organic Chemistry. 2019: 378-386. DOI: 10.1002/Ejoc.201800572 |
0.841 |
|
2018 |
Hamlin TA, Swart M, Bickelhaupt FM. Front Cover: Nucleophilic Substitution (SN
2): Dependence on Nucleophile, Leaving Group, Central Atom, Substituents, and Solvent (ChemPhysChem 11/2018) Chemphyschem. 19: 1245-1245. DOI: 10.1002/Cphc.201800352 |
0.69 |
|
2017 |
Rutledge KM, Hamlin TA, Baldisseri DM, Bickelhaupt FM, Peczuh MW. Macrocycles All Aflutter: Substitution at an Allylic Center Reveals the Conformational Dynamics of [13]-Macrodilactones. Chemistry, An Asian Journal. PMID 28783877 DOI: 10.1002/Asia.201700997 |
0.694 |
|
2017 |
Levandowski BJ, Hamlin TA, Bickelhaupt FM, Houk KN. The Role of Orbital Interactions and Activation Strain (Distortion Energies) on Reactivities in the Normal and Inverse Electron-Demand Cycloadditions of Strained and Unstrained Cycloalkenes. The Journal of Organic Chemistry. PMID 28712288 DOI: 10.1021/Acs.Joc.7B01673 |
0.74 |
|
2017 |
Hamlin TA, Poater J, Fonseca Guerra C, Bickelhaupt FM. B-DNA model systems in non-terran bio-solvents: implications for structure, stability and replication. Physical Chemistry Chemical Physics : Pccp. PMID 28497822 DOI: 10.1039/C7Cp01908D |
0.669 |
|
2016 |
Loman JJ, Carnaghan ER, Hamlin TA, Ovian JM, Kelly CB, Mercadante MA, Leadbeater NE. A combined computational and experimental investigation of the oxidative ring-opening of cyclic ethers by oxoammonium cations. Organic & Biomolecular Chemistry. PMID 27031501 DOI: 10.1039/C6Ob00347H |
0.789 |
|
2016 |
Magpusao AN, Rutledge K, Hamlin TA, Lawrence JM, Mercado BQ, Leadbeater NE, Peczuh MW. Rules of Macrocycle Topology: A [13]-Macrodilactone Case Study. Chemistry (Weinheim An Der Bergstrasse, Germany). 22: 6001-11. PMID 27001347 DOI: 10.1002/Chem.201504684 |
0.553 |
|
2015 |
Hamlin TA, Leadbeater NE. Real-time Monitoring of Reactions Performed Using Continuous-flow Processing: The Preparation of 3-Acetylcoumarin as an Example. Journal of Visualized Experiments : Jove. PMID 26650190 DOI: 10.3791/52393 |
0.545 |
|
2015 |
Hamlin TA, Kelly CB, Ovian JM, Wiles RJ, Tilley LJ, Leadbeater NE. Toward a Unified Mechanism for Oxoammonium Salt-Mediated Oxidation Reactions: A Theoretical and Experimental Study Using a Hydride Transfer Model. The Journal of Organic Chemistry. 80: 8150-67. PMID 26167866 DOI: 10.1021/Acs.Joc.5B01240 |
0.831 |
|
2015 |
Hamlin TA, Hamann CS, Tantillo DJ. Delocalization of charge and electron density in the humulyl cation—implications for terpene biosynthesis. The Journal of Organic Chemistry. 80: 4046-53. PMID 25822613 DOI: 10.1021/Acs.Joc.5B00381 |
0.592 |
|
2015 |
Hamlin TA, Kelly CB, Ovian JM, Wiles RJ, Tilley LJ, Leadbeater NE. Toward a Unified Mechanism for Oxoammonium Salt-Mediated Oxidation Reactions: A Theoretical and Experimental Study Using a Hydride Transfer Model Journal of Organic Chemistry. 80: 8150-8167. DOI: 10.1021/acs.joc.5b01240 |
0.832 |
|
2015 |
Hamlin TA, Hamann CS, Tantillo DJ. Delocalization of charge and electron density in the humulyl cation-implications for terpene biosynthesis Journal of Organic Chemistry. 80: 4046-4053. DOI: 10.1021/acs.joc.5b00381 |
0.479 |
|
2014 |
Hamlin TA, Kelly CB, Cywar RM, Leadbeater NE. Methylenation of perfluoroalkyl ketones using a Peterson olefination approach. The Journal of Organic Chemistry. 79: 1145-55. PMID 24410210 DOI: 10.1021/Jo402577N |
0.721 |
|
2014 |
Bobbitt JM, Bartelson AL, Bailey WF, Hamlin TA, Kelly CB. Oxoammonium salt oxidations of alcohols in the presence of pyridine bases. The Journal of Organic Chemistry. 79: 1055-67. PMID 24386938 DOI: 10.1021/Jo402519M |
0.569 |
|
2014 |
Mercadante MA, Kelly CB, Hamlin TA, Delle Chiaie KR, Drago MD, Duffy KK, Dumas MT, Fager DC, Glod BLC, Hansen KE, Hill CR, Leising RM, Lynes CL, Macinnis AE, McGohey MR, et al. 1,3-γ-Silyl-elimination in electron-deficient cationic systems Chemical Science. 5: 3983-3994. DOI: 10.1039/C4Sc01732C |
0.812 |
|
2014 |
Hamlin TA, Lazarus GML, Kelly CB, Leadbeater NE. A continuous-flow approach to 3,3,3-trifluoromethylpropenes: Bringing together grignard addition, peterson elimination, inline extraction, and solvent switching Organic Process Research and Development. 18: 1253-1258. DOI: 10.1021/Op500190J |
0.667 |
|
2013 |
Hamlin TA, Leadbeater NE. Raman spectroscopy as a tool for monitoring mesoscale continuous-flow organic synthesis: Equipment interface and assessment in four medicinally-relevant reactions. Beilstein Journal of Organic Chemistry. 9: 1843-52. PMID 24062851 DOI: 10.3762/Bjoc.9.215 |
0.604 |
|
2013 |
Hamlin TA, Leadbeater NE. Raman spectroscopy as a tool for monitoring mesoscale continuous-flow organic synthesis: Equipment interface and assessment in four medicinally-relevant reactions Beilstein Journal of Organic Chemistry. 9: 1843-1852. DOI: 10.3762/bjoc.9.215 |
0.498 |
|
2013 |
Hamlin TA, Kelly CB, Leadbeater NE. Dehydrogenation of perfluoroalkyl ketones by using a recyclable oxoammonium salt European Journal of Organic Chemistry. 3658-3661. DOI: 10.1002/Ejoc.201300392 |
0.727 |
|
2013 |
Leadbeater NE, Schmink JR, Hamlin TA. Tools for Monitoring Reactions Performed Using Microwave Heating Microwaves in Organic Synthesis: Third Edition. 1: 347-376. DOI: 10.1002/9783527651313.ch8 |
0.762 |
|
2012 |
Kelly CB, Mercadante MA, Hamlin TA, Fletcher MH, Leadbeater NE. Oxidation of α-trifluoromethyl alcohols using a recyclable oxoammonium salt. The Journal of Organic Chemistry. 77: 8131-41. PMID 22931546 DOI: 10.1021/Jo301477S |
0.772 |
|
Show low-probability matches. |