529-0042-00L  Structure Elucidation by NMR

SemesterSpring Semester 2023
LecturersM.‑O. Ebert
Periodicityyearly recurring course
Language of instructionEnglish


AbstractStructure Elucidation of Complex Organic Molecules by NMR
ObjectiveStructure elucidation of complex organic molecules (including peptides, oligosaccharides and oligonucleotides) by advanced 1D and 2D NMR spectroscopy: Finding the constitution, rel. configuration and the conformation of an unkown molecule. The emphasis of the course is on the selection of optimal strategies for the solution of a given problem. Discussing and solving these problems by the combined application of various 2D methods form an important part of the course. This also includes the use of state-of-the-art methods for computer assisted structure elucdation (CASE) and chemical shift prediction.
ContentImportant experiments for structure elucidation. Finding the optimal strategy for a given problem. Spectral processing for optimal results. Spectral interpretation. Assignment strategies for complex molecules. Common Artefacts. Computer assisted structure elucidation incl. introduction to relevant software and hands-on application. Chemical shift prediction. Discussion of challenging problem sets during class.
Lecture notesScripts (in English) are distributed in the course
Literature"T.D.W. Claridge, High Resolution NMR Techniques in Organic Chemistryî, Pergamon Press, 1999. (NMR Teil)

Further reading and citations are listed in the script.
Prerequisites / NoticeThe course language is English.
Required level:
Courses in analytical chemistry of the 2nd year or equivalent.
CompetenciesCompetencies
Subject-specific CompetenciesConcepts and Theoriesassessed
Techniques and Technologiesassessed
Method-specific CompetenciesAnalytical Competenciesassessed
Decision-makingassessed
Media and Digital Technologiesfostered
Problem-solvingassessed
Personal CompetenciesCreative Thinkingfostered
Critical Thinkingfostered