Publications of the IRTG 2678
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Publications from research projects of the IRTG 2678 (chronological order).

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Thermal and photoinduced radical cascade annulation using aryl isonitriles: An approach to quinoline-derived benzophosphole oxides,
S. K. Banjare, L. Lezius, E. S. Horst, D. Leifert, C. G. Daniliuc, F. A. Alasmary, A. Studer,
Angew. Chem. Int. Ed. 2024, 63, e202404275. [doi:10.1002/anie.202404275]
Toc 40
© Wiley (Publisher)
Regio- and Stereo-Selective Isomerization of Borylated 1,3-Dienes Enabled by Selective Energy Transfer Catalysis,
B. Kweon, L. Blank, J. Soika, A. Messara, C. Daniliuc, R. Gilmour,
Angew. Chem. Int. Ed. 2024, 63, e202404233. [doi:10.1002/anie.202404233]
Toc 39
© Wiley (Publisher)
Double Strain-Release [2π+2σ]-Photocycloaddition,
S. Dutta, Y.-L. Lu, J. E. Erchinger, H. Shao, E. Studer, F. Schäfer, H. Wang, D. Rana, C. G. Daniliuc, K. N. Houk, F. Glorius,
J. Am. Chem. Soc. 2024, 146, 5232-5241. [doi:10.1021/jacs.3c11563]
Toc 37
© ACS (Publisher)
Energy transfer photocatalysis: exciting modes of reactivity ,
S. Dutta, J. E. Erchinger, F. Strieth-Kalkhoff, R. Kleinmans, F. Glorius,
Chem. Soc. Rev. 2024, 53, 1068-1089. [doi:10.1039/D3CS00190C]
Toc 36
© RSC (Publisher)
Borylative transition metal-free couplings of vinyl iodides with various nucleophiles, alkenes or alkynes,
G. Seidler, M. Schwenzer, F. Clausen, C. G. Daniliuc, A. Studer,
Chem. Sci. 2024, 15, 1672-1678. [doi:10.1039/D3SC06131K]
Toc 35
© RSC (Publisher)
Visible-Light-Mediated Selective Allylic C–H Oxygenation of Cycloalkenes,
T. Rohlfs, L. Gerken, J. L. Nova-Fernández, S. Malagón, M. Uygur, S. Cabrera, J. Alemán, O. García Mancheño,
Synlett 2024, 35, accepted. [doi:10.1055/a-2219-6907]
Toc 34
© Thieme (Publisher)
para-Selective dearomatization of phenols by I(i)/I(iii) catalysis-based fluorination,
T. Stünkel, K. Siebold, D. Okumatsu, K. Okumatsu, K. Murata, L. Ruyet, C. G. Daniliuc, R. Gilmour,
Chem. Sci. 2023, 14, 13574-13580. [doi:10.1039/D3SC05952A]
Toc 32
© RSC (Publisher)

Calamitic Liquid Crystals for Reversible Light-Modulated Phase Regulation Based on Arylazopyrazole Photoswitches,
H. Q. Trân, S. Kawano, R. E. Thielemann, K. Tanaka, B. J. Ravoo,
Chem. Eur. J. 2023, 29, e202302958. [doi:10.1002/chem.202302958];
highlighted with Cover Profile.
Toc 33
© Wiley (Publisher)
Three-Component Photochemical 1,2,5-Trifunctionalizations of Alkenes toward Densely Functionalized Lynchpins,
F. Paulus, C. Stein, C. Heusel, T. J. Stoffels, C. G. Daniliuc, F. Glorius,
J. Am. Chem. Soc. 2023, 145, 23814–23823. [doi:10.1021/jacs.3c08898]
Toc 31
© ACS (Publisher)
syn-Selective Difunctionalization of Bicyclobutanes Enabled by Photoredox-Mediated C–S σ-Bond Scission,
H. Wang, J. E. Erchinger, M. Lenz, S. Dutta, C. G. Daniliuc, F. Glorius,
J. Am. Chem. Soc. 2023, 145, 23771–23780. [doi:10.1021/jacs.3c08512]
Toc 30
© ACS (Publisher)
Sterically Allowed H-type Supramolecular Polymerizations,
R. M. Veedu, N. Niemeyer, N. Bäumer, K. K. Kalathil, J. Neugebauer, G.Fernandez,
Angew. Chem. Int. Ed. 2023, 62, e202314211. [doi:10.1002/anie.202314211]
Toc 29
© Wiley (Publisher)
Water-Soluble Arylazoisoxazole Photoswitches,
F. Höglsperger, F. A. Larik, C. Bai, M. D. Seyfried, C. Daniliuc, H. Klaasen, P. Thordarson, J. E. Beves, B. J. Ravoo,
Chem. Eur. J. 2023, 29, e202302069. [doi:10.1002/chem.202302069]
Toc 28
© Wiley (Publisher)
Amphiphile desymmetrisation-induced steric relief governs self-assembly pathways in aqueous media,
N. Bäumer, S. Ogi, L. Borsdorf, S. Yamaguchi, G. Fernández,
Chem. Commun. 2023, 59, 8937–8940. [doi:10.1039/D3CC02297H]
Toc 26
© RSC (Publisher)
Catalytic Formal [2π+2σ] Cycloaddition of Aldehydes with Bicyclobutanes: Expedient Access to Polysubstituted 2-Oxabicyclo[2.1.1]hexanes,
Y. Liang, F. Paulus, C. G. Daniliuc, F. Glorius,
Angew. Chem. Int. Ed. 2023, 62, e202305043. [doi:10.1002/anie.202305043]
Toc 25
© Wiley (Publisher)
Azoheteroarene and Diazocine Molecular Photoswitches: Self-Assembly, Responsive Materials and Photopharmacology,
A. Mukherjee, M. D. Seyfried, B. J. Ravoo,
Angew. Chem. Int. Ed. 2023, 62, e202304437. [doi:10.1002/anie.202304437]
Toc 27
© Wiley (Publisher)
Massively parallel fragment-based quantum chemistry for large molecular systems: the serestipy software,
P. Eschenbach, N. Niemeyer, J. Neugebauer,
Can. J. Chem. 2023, 101, 641-655. [doi:10.1139/cjc-2022-0243]
Pathway-Controlled Aqueous Supramolecular Polymerization via Solvent-Dependent Chain Conformation Effects,
L. Borsdorf, L. Herkert, N. Bäumer, L. Rubert, B. Soberats, P. A. Korevaar, C. Bourque, C. Gatsogiannis, G. Fernández,
J. Am. Chem. Soc. 2023, 145, 8882-8895. [doi:10.1021/jacs.2c12442]
Toc 24
© ACS (Publisher)
Enantioselective Copper-Catalyzed Fukuyama Indole Synthesis from 2-Vinylphenyl Isocyanides,
T. Drennhaus, D. Leifert, J. Lammert, J. P. Drennhaus, K. Bergander, C. G. Daniliuc, A. Studer,
J. Am. Chem. Soc. 2023, 145, 8665-8676. [doi:10.1021/jacs.3c01667]
Toc 23
© ACS (Publisher)
Facilitating [2+2] Photocycloadditions by Promoting Oxygen Tolerance and Substrate Activation in Water,
J. C. G. Kürschner, L. Brüss, L. Næsborg,
Chem. Eur. J. 2023, 29, e202300627. [doi:10.1002/chem.202300627]
Toc 22
© Wiley (Publisher)
Bioinspired crowding directs supramolecular polymerisation,
N. Bäumer, E. Castellanos, B. Soberats, G. Fernández,
Nat. Commun. 2023, 14, 1084. [doi:10.1038/s41467-023-36540-x]
Toc 18
© Springer Nature (Publisher)
Enantioselective dearomatization reactions of heteroarenes by anion-binding organocatalysis,
M. Aleksiev, O. García Mancheño,
Chem. Commun. 2023, 59, 3360-3372. [doi:10.1039/D2CC07101K]
Toc 17
© RSC (Publisher)
Metal-free photosensitized radical relay 1,4-carboimination across two distinct olefins,
G. Tan, F. Paulus, A. Petti, M.-A. Wiethoff, A. Lauer, C. G. Daniliuc, F. Glorius,
Chem. Sci. 2023, 14, 2447-2454. [doi:10.1039/D2SC06497A]
Toc 19
© RSC (Publisher)
EnT-Mediated N–S Bond Homolysis of a Bifunctional Reagent Leading to Aliphatic Sulfonyl Fluorides,
J. E. Erchinger, R. Hoogesteger, R. Laskar, S. Dutta, C. Hümpel, D. Rana, C. G. Daniliuc, F. Glorius,
J. Am. Chem. Soc. 2023, 145, 2364–2374. [doi:10.1021/jacs.2c11295]
Toc 16
© ACS (Publisher)
On the accuracy of orbital based multi-level approaches for closed-shell transition metal chemistry,
Z. Amanollahi, L. Lampe, M. Bensberg, J. Neugebauer, M. Feldt,
Phys. Chem. Chem. Phys. 2023, 25, 4635-4648. [doi:10.1039/D2CP05056K]
Toc 20
© RSC (Publisher)
The subsystem quantum chemistry program Serenity,
N. Niemeyer, P. Eschenbach, M. Bensberg, J. Tölle, L. Hellmann, L. Lampe, A. Massolle, A. Rikus, D. Schnieders, J. P. Unsleber, J. Neugebauer,
WIREs Comput. Mol. Sci. 2023, 13, e1647. [doi:10.1002/wcms.1647]
Toc 14
© Wiley (Publisher)

Impact of Hydrophobic/Hydrophilic Balance on Aggregation Pathways, Morphologies, and Excited-State Dynamics of Amphiphilic Diketopyrrolopyrrole Dyes in Aqueous Media,
N. Fukaya, S. Ogi, H. Sotome, K. J. Fujimoto, T. Yanai, N. Bäumer, G. Fernández, H. Miyasaka, S. Yamaguchi,
J. Am. Chem. Soc. 2022, 144, 22479–22492. [doi:10.1021/jacs.2c07299]
Toc 13
© ACS (Publisher)
Highly Selective Radical Relay 1,4-Oxyimination of Two Electronically Differentiated Olefins ,
G. Tan, F. Paulus, A. Retería-Gómez, R. F. Lalisse, C. G. Daniliuc, O. Gutierrez, F. Glorius,
J. Am. Chem. Soc. 2022, 144, 21664-21673. [doi:10.1021/jacs.2c09244]
Toc 12
© ACS (Publisher)
Micellar Effects and their Relevance in Photochemistry and Photocatalysis,
L. Brüss, R. Jeyaseelan, J. C. G. Kürschner, M. Utikal, L. Næsborg,
ChemCatChem 2023, 15, e202201146. [doi:10.1002/cctc.202201146]
Toc 21
© Wiley (Publisher)
Reliable Isotropic Electron-Paramagnetic-Resonance Hyperfine Coupling Constants from the Frozen-Density Embedding Quasi-Diabatization Approach,
P. Eschenbach, D. G. Artiukhin, J. Neugebauer,
J. Phys. Chem. A 2022, 157, 8358-5368. [doi:10.1021/acs.jpca.2c04959]
Toc 11
© ACS (Publisher)
Subsystem density-functional theory: A reliable tool for spin-density based properties,
P. Eschenbach, J. Neugebauer,
J. Chem. Phys. 2022, 157, 130902. [doi:10.1063/5.0103091]
Toc 10
© AIP Publishing (Publisher)
Thermoreversible Polymorph Transitions in Supramolecular Polymers of Hydrogen-Bonded Squaramides,
S. Bujosa, A. Doncel-Giménez, N. Bäumer, G. Fernández, E. Ortí, A. Costa, C. Rotger, J. Aragó, B. Soberats,
Angew. Chem. Int. Ed. 2022, 61, e202213345. [doi:10.1002/anie.202213345]
Toc 8
© Wiley (Publisher)
Chromium/Photoredox Dual Catalyzed Synthesis of α-Benzylic Alcohols, Isochromanones, 1,2-Oxy Alcohols and 1,2-Thio Alcohols,
S. Dutta, J. E. Erchinger, F. Schäfer, A. Das, C. G. Daniliuc, F. Glorius,
Angew. Chem. Int. Ed. 2022, 61, e202212136. [doi:10.1002/anie.202212136]
Toc 15
© Wiley (Publisher)
Oxy-Borylenes as Photoreductants: Synthesis and Application in Dehalogenation and Detosylation Reactions,
P. Lenz, R. Oshimizu, S. Klabunde, C. G. Daniliuc, C. Mück-Lichtenfeld, J. C. Tendyck, T. Mori, W. Uhl, M. R. Hansen, H. Eckert, S. Yamaguchi, A. Studer,
Angew. Chem. Int. Ed. 2022, 61, e202209391. [doi:10.1002/anie.202209391]
Toc 7
© Wiley (Publisher)
Visible-Light Photocatalyzed peri-(3 + 2) Cycloadditions of Quinolines,
P. Bellotti, T. Rogge, F. Paulus, R. Laskar, N. Rendel, J. Ma, K. N. Houk, F. Glorius,
J. Am. Chem. Soc. 2022, 144, 15662-15671. [doi:10.1021/jacs.2c05687]
Toc 6
© ACS (Publisher)
Direct Access to Unnatural Cyclobutane α-Amino Acids through Visible Light Catalyzed [2+2]-Cycloaddition,
M. Stinglhamer, X. Yzeiri, T. Rohlfs, T. Brandhofer. C. G. Daniliuc, O. G. Mancheño,
ACS Org. Inorg. Au 2022, 2, 496-501. [doi:10.1021/acsorginorgau.2c00026]
Toc 9
© ACS (Publisher)
Regio- and Enantioselective Intermolecular Aminofluorination of Alkenes via Iodine(I)/Iodine(III) Catalysis,
M. Schäfer, T. Stünkel, C. G. Daniliuc and R. Gilmour,
Angew. Chem. Int. Ed. 2022, 61, e202205508. [doi:10.1002/anie.202205508]
Toc 5
© Wiley (Publisher)
A negative-solvatochromic fluorescent probe for visualizing intracellular distributions of fatty acid metabolites,
K. Kajiwara, H. Osaki, S. Greßies, K. Kuwata, J. H. Kim, T. Gensch, Y. Sato, F. Glorius, S. Yamaguchi, M. Taki,
Nat. Commun. 2022, 13, 1370. [doi:10.1038/s41467-022-29086-x]
Toc 4
© Springer Nature (Publisher)
Expanding the Scope of MetastableSpecies in Hydrogen Bonding-Directed SupramolecularPolymerization,
J. Matern, Z. Fernández, N. Bäumer, G. Fernández,
Angew. Chem. Int. Ed. 2022, 61, e202203783. [doi:10.1002/anie.202203783]
Toc 3
© Wiley (Publisher)
Anti-cooperative Self-Assembly with Maintained Emission Regulated by Conformational and Steric Effects,
I. Helmers, M. S. Hossain, N. Bäumer, P. Wesarg, B. Soberats, L. S. Shimizu, G. Fernández,
Angew. Chem. Int. Ed. 2022, 61, e202200390. [doi:10.1002/anie.202200390]
Toc 2
© Wiley (Publisher)

Regio- and Stereoselective 1,2-Carboboration of Ynamides with Aryldichloroboranes,
C. You, M. Sakai, C. G. Daniliuc, K. Bergander, S. Yamaguchi, A. Studer,
Angew. Chem. Int. Ed. 2021, 60, 21697-21701. [doi:10.1002/anie.202107647]
Toc 1
© Wiley (Publisher)