Universität Wien

270232 VO Molecular Modelling in Organic and Inorganic Chemistry (2022W)

4.00 ECTS (2.00 SWS), SPL 27 - Chemie
Moodle

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Details

Language: German, English

Examination dates

Lecturers

Classes

First meeting:
Wednesday, 5.10.2022, 14:00-15:30
Room: Währinger Straße 17, PC-Pool on the second floor

Further dates are Wednesdays, 14:00-15:30 (to be discussed at the first meeting).
The unit of 30.11.22 is (exceptionally!) rescheduled to Thursday 1.12.22.

Information

Aims, contents and method of the course

The course aims to understand and calculate synthetic chemistry from a theoretical point of view. For this purpose, modern software packages are used to calculate, e.g., transition states and energy barriers. In this way, reaction mechanisms are to be elucidated.

Assessment and permitted materials

Written exam at the end of the course.

Minimum requirements and assessment criteria

Examination topics

All contents covered in the lecture.

Reading list

Jensen "Introduction to Computational Chemistry"
Cramer "Essentials of Computational Chemistry: Theories and Models"

Association in the course directory

CH-SYN-01, TC-1

Last modified: Fr 20.01.2023 08:49