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XIV.K.2.

Transition State Vibrational Frequencies

N2O + H = N2 + OH


The one imaginary frequency is shown. Click on an entry for all the vibrational frequencies.
Vibrational frequency in cm-1
Methods with predefined basis sets
semi-empirical PM3 2102i

Vibrational frequency in cm-1
Methods with standard basis sets
6-31G* 6-31+G**
hartree fock HF 40i 1099i
For descriptions of the methods (AM1, HF, MP2, ...) and basis sets (3-21G, 3-21G*, 6-31G, ...) see the glossary in section I.C. Predefined means the basis set used is determined by the method.