Subject: Subject Sylbus: Molecular Orbitals in Organic Chemistry - 127710

Molecular Orbitals in Organic Chemistry - 127710
Will not be given the year
Credit
Points
2.0
 
  Lecture Exercise Laboratory Project or
Seminar
House
Work
Weekly
Hours
2       4
Possibility to guided reading

Determination of the grade according to the final examination.


Prerequisites: ( Quantum Chemistry 1 124400
and Structure and Activity in Organic Chem. 124703 )
or ( Intr.to Quantum Chemi.and Applications 124408
and Structure and Activity in Organic Chem. 124703 )


Atomic Orbitals, the Functions and Their Shapes, Tpes of Orbitals, Basis Sets. Molecular Orbitals (Md). Overlap Integrals. Mo'S Symmetries of and Types. Mathematical and Structural Construction of Mo. Introduction to Pmo. Application of Pmo in Construction of Mo. Symmetry and Character Tables. Using Symmetry in Construction of Mo. Building Mo of Fundamental Fragments and Using Them for Construction of Mo for Larger Systems. Hybridization. through Space and through Bond Interactions. Basic Usage of the Gaussian Software. Building a Z-Matrix, Reading the Output.


Created in 01/03/2021 Time 19:28:58