Deutsch
English
In addition to practical research, theoretical support is provided for the students' own practical work as well as within the framework of numerous collaborations at the Institute of Organic Chemistry, with other working groups at Clausthal University of Technology and for working groups at various other universities. In addition to a deeper understanding of organic chemical reactions and reaction mechanisms, the focus is on analytical questions (IR, Raman, 13C-NMR, UV, etc.), quantum chemical descriptors (NICS, NBO charges, Fukui indices, etc.) as well as interactions between functional groups and surfaces and polymer-physical simulations. Density functional theory is primarily used for this purpose. For this purpose, 6 nodes with 34 computing cores and Infiniband Interconnect are currently available on a small computing cluster.
Selected publications:
Eur. J. Org. Chem. 2023, e202300216: Sydnone Methides: Intermediates between Mesoionic Compounds and Mesoionic N-Heterocyclic Olefins
Dalton Trans. 2022, 51, 3902 - 3912: p-Block metal complexes with bis(pyrazol-1-yl)acetato ligands
Angew. Chem. Int. Ed. 2021, 60, 18882 - 18887: Sydnone methides - a forgotten class of mesoionic compounds for the generation of anionic N-heterocyclic carbenes
Eur. J. Org. Chem. 2021, 3178 - 3189: Switchable mesomeric betaines derived from pyridinium phenolates and bis(thienyl)ethane
Org. biomol. Chem. 2019, 17, 4102 - 4114: Synthesis and characterization of propeller-shaped mono- to hexacationic quinolinium-substituted benzenes
Org. biomol. Chem. 2018, 16, 6801 - 6808: Purine-substituted imidazolium mesomeric betaines and their tautomeric N-heterocyclic carbenes. Formation of a cyclic borane adduct
Polym. Chem. 2017, 8, 7546 - 7558: Hybrid single-chain nanoparticles via the metal induced crosslinking of N-donor functionalized polymer chains
Tetrahedron 2017, 73, 4472 - 4480: Reaction of N-heterocyclic carbaldehydes with furanones - an investigation of reactivity and regioselectivity
Chem. Eur. J. 2016, 22, 5416 - 5424: Formation of N-heterocyclic carbenes by Tautomerization of Mesomeric Betaines. Cyclic Boron Adducts and Palladium Complexes starting from 2-(Imidazolium-1-yl)phenolates
New J. Chem. 2016, 40, 6127 - 6134: Carbon Rich Cyclopentadienyl Ruthenium Allenylidene Complexes
Chem. Commun. 2014, 50, 11822 - 11824: Sydnone anions and abnormal N-heterocyclic carbenes of O-ethylsydnones. Characterizations, calculations and catalyses
Eur. J. Org. Chem. 2013, Issue 36, 8185 - 8196: Palladium-Catalyzed Cross-Coupling of 2-Chloroquinoxaline N-Oxides with Arylboronic Acids
Soft Matter 2013, 44, 10559 - 10571: A microscopic view on the large scale chain dynamics in nanocomposites with attractive interactions
Dalton trans. 2010, 39, 2049 - 2056: Studies on an iron(III)-peroxo porphyrin. Iron(III)-peroxo or iron(II)-superoxo?