Publications 2024
- Competitive Heavy-atom Tunneling Reactions Controlled Through Electronic Effects. José P. L. Roque, Cláudio M. Nunes,* Fumito Saito, Bastian Bernhardt, Rui Fausto, Peter R. Schreiner
ChemistryEurope 2024, xx, in press. DOI: 10.1002/ceur.202400060. - Contrasting Historical and Physical Perspectives in Asymmetric Catalysis: ∆∆G‡ versus enantiomeric excess. Marcel Ruth, Tobias Gensch,* and Peter R. Schreiner
Angew. Chem. Int. Ed. 2024, 63, e202410308. DOI: 10.1002/anie.202410308. - Experimentally Delineating the Catalytic Effect of a Single Water Molecule in the Photochemical Rearrangement of the Phenylperoxy Radical to the Oxepin-2(5H)-one-5-yl Radical. Artur Mardyukov, Federico J. Hernandez, Lijuan Song, Rachel Crespo-Otero, and Peter R. Schreiner
J. Am. Chem. Soc. 2024, 146, 19070–19076. DOI: 10.1021/jacs.4c03461. - H-Tunneling Exhibiting Unexpectedly Small Kinetic Isotope Effects. José P. L. Roque, Cláudio M. Nunes,* Peter R. Schreiner, Rui Fausto
Chem. Eur. J. 2024, 30, e202401323. DOI: 10.1002/chem.202401323. Highlight: Front cover of this issue, DOI: 10.1002/chem.202402234. - The Enol of Isobutyric Acid. Akkad Danho, Artur Mardyukov, and Peter R. Schreiner
Chem. Commun. 2024, 60, 5161–5164. DOI: 10.1039/D4CC01140F. - Theoretical investigation of the amorphous structure of different molecular cluster materials with molecular dynamics simulations. Functionalized Nanodiamonds, part 99. Sebastian Schwan, Peter R. Schreiner, and Doreen Mollenhauer
J. Chem. Theory Comput. 2024, yy, in press. DOI: 10.1021/acs.jctc.4c00196. - Adamantane-Type Clusters: Beautiful Compounds with Unexpected Materials Properties. Functionalized Nanodiamonds, part 98. Niklas Rinn, Irán Rojas-León, Benjamin Peerless, Saravanan Gowrisankar, Ferdinand Ziese, Nils W. Rosemann, Wolf-Christian Pilgrim, Simone Sanna, Peter R. Schreiner, and Stefanie Dehnen
Chem. Sci. 2024, 15, 9438–9505. DOI: 10.1039/D4SC01136H. Higlight: Part of the “Hot Article” collection of Chem. Sci. - Leveraging Limited Experimental Data with Machine Learning: Differentiating a Methyl from an Ethyl Group in the CBS-Reduction. Οliver Pereira, Marcel Ruth, Dennis Gerbig, Raffael C. Wende, and Peter R. Schreiner
J. Am. Chem. Soc. 2024, 146, 14576–14586. DOI: 10.1021/jacs.4c01286. - Polymorphism and White Light Emission of 1-bromo-3,5,7-triphenyladamantane Compared with 1,3,5,7-tetraphenyladamantane. Saravanan Gowrisankar, Andrey A. Fokin, Jonathan Becker, Neeshma Mathew, Jörn Schmedt auf der Günne, and Peter R. Schreiner
Eur. J. Org. Chem. 2024, e202400260. DOI: 10.1002/ejoc.202400260. - The Structure of [18]Annulene Revisited: Consequences for Computing Benzenoid Systems. Rollin A. King,* T. Daniel Crawford,* and Peter R. Schreiner
J. Phys. Chem. A 2024, 128, 1098–1108. DOI: 10.1021/acs.jpca.3c07797. - Determining Ultra-Low Odor Organic Molecular Thresholds in Air. Fabio F. Brescia, Jan Passinger, Raffael C. Wende, Peter R. Schreiner, Holger Zorn, and Marco A. Fraatz
J. Agricult. Food Chem. 2024, 72, 7511–7516. DOI: 10.1021/acs.jafc.3c08438. - Advances and Prospects in Understanding London Dispersion Interactions in Molecular Chemistry. Lars Rummel and Peter R. Schreiner
Angew. Chem. Int. Ed. 2024, 63, e202316364. DOI: 10.1002/anie.202316364. Higlight: ChemistryViews March 16, 2024. - Quantifying Intermolecular Interactions in Asymmetric Peptide Organocatalysis as a Key Towards Understanding Selectivity. Jens Nowag, Matthias Brauser, Raffael C. Wende, Peter R. Schreiner, and Christina M. Thiele
J. Am. Chem. Soc. 2024, 146, 170–180. DOI: 10.1021/jacs.3c06378. - Organocatalytic, Chemoselective, and Stereospecific House-Meinwald Rearrangement of Trisubstituted Epoxides. Friedemann Dressler, Victoria Öhler, Christopher Topp, and Peter R. Schreiner
Synlett 2024, 36, 1052–1056. DOI: 1055/a-2216-4710. - Preparation of Spirocyclic Vinylic Carbonates from Allylic Alcohols. Christopher Topp, Jan M. Metzler, Friedemann Dressler, Dominik Niedek, Sören M. M. Schuler, and Peter R. Schreiner
Org. Lett. 2024, 26, 577–580. DOI: 10.1021/acs.orglett.3c03253.