Projects funded by the NCN
Ab initio Molecular Dynamics Study on the Influence of Noncovalent Interactions on Mechanochemical Reactivity of Disulfides
2020/37/B/ST4/00423
Keywords:
mechanochemistry hydrogen bonds chalcogen-chalcogen interactions ab initio molecular dynamics quantum mechanical calculations
Descriptors:
- ST4_003:
- ST4_004:
Panel:
ST4 - Chemistry: physical chemistry/chemical physics, theoretical chemistry, analytical chemistry, inorganic chemistry, organic chemistry, method development
Host institution :
Uniwersytet Wrocławski, Wydział Chemii
woj. dolnośląskie
Principal investigator (from the host institution):
dr Przemysław Damian Dopieralski
Number of co-investigators in the project: 3
Call: OPUS 19 - announced on 2020-03-16
Amount awarded: 432 240 PLN
Project start date (Y-m-d): 2021-02-01
Project end date (Y-m-d): 2026-01-31
Project duration:: 60 months (the same as in the proposal)
Project status: Pending project
Project description
Download the project description in a pdf file
Note - project descriptions were prepared by the authors of the applications themselves and placed in the system in an unchanged form.
Information in the final report
- Publication in academic press/journals (1)
- Role of Solvent and Noncovalent Interactions in Alkaline Reactivity of Strained and Strain-Free Macrocyclic DisulfidesAuthors:Dopieralski P., Bil A.Academic press:Chem. Eur. J. (rok: 2024, tom: 30, strony: e202402982), Wydawca: WileyStatus:PublishedDOI:10.1002/chem.202402982 - link to the publication