Vibrational Modes of 1,6 dimethyl naphthalene


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


Scale Factor : 0.961


Frequency unit : 1/cm

 


1                     -100.0
Scaled : -96.1
2                     104.5
Scaled : 100.4
3                     144.8
Scaled : 139.1

4                     188.4
Scaled : 181.0
5                     235.8
Scaled : 226.6
6                     249.1
Scaled : 239.4

7                     284.0
Scaled : 272.9
8                     326.9
Scaled : 314.2
9                     425.0
Scaled : 408.4

10                     458.2
Scaled : 440.3
11                     462.3
Scaled : 444.3
12                     495.0
Scaled : 475.7

13                     510.8
Scaled : 490.9
14                     559.0
Scaled : 537.2
15                     583.9
Scaled : 561.1

16                     644.5
Scaled : 619.4
17                     702.5
Scaled : 675.1
18                     729.9
Scaled : 701.4

19                     765.9
Scaled : 736.0
20                     803.5
Scaled : 772.1
21                     833.6
Scaled : 801.1

22                     844.9
Scaled : 811.9
23                     892.9
Scaled : 858.1
24                     917.5
Scaled : 881.7

25                     941.6
Scaled : 904.9
26                     967.0
Scaled : 929.3
27                     976.9
Scaled : 938.8

28                     998.1
Scaled : 959.2
29                     1032.7
Scaled : 992.4
30                     1062.5
Scaled : 1021.1

31                     1066.5
Scaled : 1024.9
32                     1078.2
Scaled : 1036.2
33                     1105.9
Scaled : 1062.8

34                     1189.5
Scaled : 1143.1
35                     1197.3
Scaled : 1150.6
36                     1197.8
Scaled : 1151.1

37                     1254.8
Scaled : 1205.8
38                     1279.4
Scaled : 1229.5
39                     1298.5
Scaled : 1247.8

40                     1388.4
Scaled : 1334.2
41                     1401.7
Scaled : 1347.1
42                     1416.9
Scaled : 1361.6

43                     1426.5
Scaled : 1370.9
44                     1427.4
Scaled : 1371.7
45                     1468.3
Scaled : 1411.0

46                     1497.2
Scaled : 1438.8
47                     1497.8
Scaled : 1439.4
48                     1500.7
Scaled : 1442.2

49                     1512.1
Scaled : 1453.1
50                     1521.0
Scaled : 1461.7
51                     1561.9
Scaled : 1501.0

52                     1630.3
Scaled : 1566.7
53                     1658.9
Scaled : 1594.2
54                     1682.0
Scaled : 1616.4

55                     3035.3
Scaled : 2916.9
56                     3041.0
Scaled : 2922.4
57                     3087.8
Scaled : 2967.4

58                     3097.0
Scaled : 2976.2
59                     3124.4
Scaled : 3002.6
60                     3127.0
Scaled : 3005.1

61                     3163.7
Scaled : 3040.3
62                     3173.1
Scaled : 3049.3
63                     3175.2
Scaled : 3051.4

64                     3181.0
Scaled : 3056.9
65                     3199.4
Scaled : 3074.6
66                     3207.3
Scaled : 3082.2

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.