Vibrational Modes of Metaxylene


Level of Theory : HF/6-31G(d)


Frequency unit : 1/cm

 


1     -28.7656    A2


2     -24.3946    B1


3     219.9823    B1


4     239.2665    A2


5     292.1609    A1


6     431.8782    B2


7     486.7795    B1


8     557.2490    B2


9     575.7791    A2


10     576.6798    A1


11     770.5784    B1


12     784.8573    A1


13     876.1145    B1


14     989.4554    B2


15     995.1351    B1


16    1014.3575    A2


17    1083.7638    A1


18    1092.6923    B2


19    1098.4813    A1


20    1107.1409    B1


21    1171.3846    A2


22    1173.7063    B1


23    1210.3637    A1


24    1249.0841    B2


25    1289.3205    B2


26    1331.3891    B2


27    1371.1906    A1


28    1467.2339    B2


29    1565.9385    B2


30    1567.6072    A1


31    1588.1961    A1


32    1632.1618    A2


33    1632.7704    B1


34    1633.8918    B2


35    1651.6392    A1


36    1669.0184    B2


37    1789.7803    A1


38    1815.7018    B2


39    3201.5722    B2


40    3202.1570    A1


41    3253.2383    A2


42    3253.4547    B1


43    3278.5375    A1


44    3278.5820    B2


45    3341.9659    A1


46    3347.8401    A1


47    3351.3075    B2


48    3373.3930    A1

These movies were created by Mohamad Kassaee and David Keffer in the Department of Chemical Engineering at the University of Tennessee, using a combination of Gaussian98 and home-made codes. Please do not reproduce them without our consent. We can be reached via email at dkeffer@utk.edu.