Vibrational Modes of 1,5 dimethyl naphthalene


Level of Theory : B3LYP/6-31G(d,p)


Scale Factor : 0.961


Frequency unit : 1/cm

 


1                     96.1
Scaled : 92.4
2                     165.5
Scaled : 159.1
3                     184.8
Scaled : 177.6

4                     193.7
Scaled : 186.1
5                     207.4
Scaled : 199.3
6                     260.0
Scaled : 249.8

7                     270.3
Scaled : 259.8
8                     331.7
Scaled : 318.8
9                     466.1
Scaled : 447.9

10                     467.2
Scaled : 449.0
11                     482.0
Scaled : 463.2
12                     492.7
Scaled : 473.5

13                     518.4
Scaled : 498.1
14                     535.6
Scaled : 514.7
15                     582.1
Scaled : 559.4

16                     642.9
Scaled : 617.8
17                     644.6
Scaled : 619.5
18                     750.7
Scaled : 721.4

19                     798.1
Scaled : 767.0
20                     807.9
Scaled : 776.4
21                     820.3
Scaled : 788.3

22                     864.8
Scaled : 831.1
23                     891.8
Scaled : 857.1
24                     903.3
Scaled : 868.1

25                     915.4
Scaled : 879.7
26                     976.8
Scaled : 938.7
27                     977.5
Scaled : 939.4

28                     1006.5
Scaled : 967.3
29                     1035.9
Scaled : 995.5
30                     1064.9
Scaled : 1023.4

31                     1066.4
Scaled : 1024.8
32                     1096.1
Scaled : 1053.4
33                     1126.0
Scaled : 1082.0

34                     1163.9
Scaled : 1118.5
35                     1201.4
Scaled : 1154.6
36                     1202.0
Scaled : 1155.1

37                     1248.0
Scaled : 1199.4
38                     1262.5
Scaled : 1213.3
39                     1288.2
Scaled : 1237.9

40                     1381.0
Scaled : 1327.1
41                     1398.8
Scaled : 1344.3
42                     1426.2
Scaled : 1370.6

43                     1426.7
Scaled : 1371.1
44                     1447.2
Scaled : 1390.8
45                     1450.9
Scaled : 1394.3

46                     1497.2
Scaled : 1438.8
47                     1497.3
Scaled : 1438.9
48                     1506.8
Scaled : 1448.0

49                     1511.0
Scaled : 1452.0
50                     1521.0
Scaled : 1461.7
51                     1562.1
Scaled : 1501.1

52                     1640.5
Scaled : 1576.5
53                     1656.0
Scaled : 1591.4
54                     1672.1
Scaled : 1606.9

55                     3035.7
Scaled : 2917.3
56                     3035.8
Scaled : 2917.4
57                     3088.1
Scaled : 2967.7

58                     3088.5
Scaled : 2968.0
59                     3126.3
Scaled : 3004.4
60                     3126.5
Scaled : 3004.6

61                     3173.6
Scaled : 3049.8
62                     3174.2
Scaled : 3050.4
63                     3190.8
Scaled : 3066.3

64                     3191.0
Scaled : 3066.5
65                     3213.0
Scaled : 3087.7
66                     3213.4
Scaled : 3088.1

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.