Vibrational Modes of 1,4 dimethyl naphthalene


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


Scale Factor : 0.961


Frequency unit : 1/cm

 


1                     -196.2
Scaled : -188.5
2                     112.8
Scaled : 108.4
3                     128.6
Scaled : 123.6

4                     187.2
Scaled : 179.9
5                     193.2
Scaled : 185.6
6                     285.8
Scaled : 274.7

7                     318.6
Scaled : 306.2
8                     333.6
Scaled : 320.6
9                     422.7
Scaled : 406.2

10                     456.3
Scaled : 438.5
11                     480.1
Scaled : 461.4
12                     489.3
Scaled : 470.3

13                     503.7
Scaled : 484.0
14                     546.9
Scaled : 525.6
15                     580.8
Scaled : 558.2

16                     637.9
Scaled : 613.0
17                     706.0
Scaled : 678.4
18                     740.2
Scaled : 711.4

19                     770.0
Scaled : 739.9
20                     790.0
Scaled : 759.2
21                     807.0
Scaled : 775.5

22                     843.7
Scaled : 810.8
23                     873.2
Scaled : 839.2
24                     946.9
Scaled : 910.0

25                     952.6
Scaled : 915.4
26                     958.1
Scaled : 920.7
27                     989.1
Scaled : 950.6

28                     1016.6
Scaled : 976.9
29                     1051.5
Scaled : 1010.5
30                     1053.0
Scaled : 1012.0

31                     1066.9
Scaled : 1025.3
32                     1078.4
Scaled : 1036.4
33                     1084.4
Scaled : 1042.1

34                     1180.0
Scaled : 1133.9
35                     1188.9
Scaled : 1142.5
36                     1194.3
Scaled : 1147.7

37                     1255.2
Scaled : 1206.2
38                     1274.3
Scaled : 1224.6
39                     1296.5
Scaled : 1246.0

40                     1370.2
Scaled : 1316.7
41                     1396.1
Scaled : 1341.7
42                     1423.0
Scaled : 1367.5

43                     1427.0
Scaled : 1371.3
44                     1430.8
Scaled : 1375.0
45                     1472.8
Scaled : 1415.3

46                     1495.3
Scaled : 1436.9
47                     1498.1
Scaled : 1439.6
48                     1500.4
Scaled : 1441.9

49                     1514.9
Scaled : 1455.9
50                     1516.9
Scaled : 1457.8
51                     1568.6
Scaled : 1507.4

52                     1640.3
Scaled : 1576.3
53                     1651.7
Scaled : 1587.2
54                     1672.5
Scaled : 1607.3

55                     3033.9
Scaled : 2915.6
56                     3047.5
Scaled : 2928.6
57                     3086.2
Scaled : 2965.8

58                     3096.9
Scaled : 2976.1
59                     3124.3
Scaled : 3002.5
60                     3156.1
Scaled : 3033.0

61                     3165.7
Scaled : 3042.2
62                     3180.5
Scaled : 3056.5
63                     3183.8
Scaled : 3059.7

64                     3194.8
Scaled : 3070.2
65                     3212.9
Scaled : 3087.6
66                     3217.6
Scaled : 3092.1

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.