Figure 3.82

In this figure we see the 3D structure of the 2-norbornyl cation as calculated at the MP2/def2QZVPP level of theory.

norb_002b.mol

The corresponding Gaussian input file for the 2-norbornyl cation is:

#P MP2(FC)/def2qzvpp MaxDisk=200GB SCF=tight                                          

MP2(FC)/def2qzvpp  sp min norbornyl cation                               

+1 1     
C         -1.17505       -0.06973        0.00000 
C         -0.56641        0.67946       -1.18993 
C          0.84726        0.78699       -0.69634 
C          0.84726        0.78699        0.69634 
C         -0.56641        0.67946        1.18993 
C         -0.40325       -1.39135        0.00000 
C          1.02861       -0.89014        0.00000 
H         -2.25550       -0.15195        0.00000 
H         -0.96594        1.69143       -1.28832 
H         -0.65910        0.16640       -2.14301 
H          1.70906        1.03376       -1.29923 
H          1.70906        1.03376        1.29923 
H         -0.65910        0.16640        2.14301 
H         -0.96594        1.69143        1.28832 
H         -0.60959       -1.98673       -0.88474 
H         -0.60959       -1.98673        0.88474 
H          1.64730       -1.11972        0.86804 
H          1.64730       -1.11972       -0.86804