Vibrational Modes of 2,6 dimethyl naphthalene


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


Scale Factor : 0.961


Frequency unit : 1/cm

 


1                     77.8
Scaled : 74.7
2                     87.2
Scaled : 83.8
3                     96.7
Scaled : 92.9

4                     184.9
Scaled : 177.7
5                     206.8
Scaled : 198.7
6                     222.1
Scaled : 213.4

7                     322.4
Scaled : 309.8
8                     343.1
Scaled : 329.8
9                     406.7
Scaled : 390.8

10                     413.2
Scaled : 397.1
11                     441.9
Scaled : 424.7
12                     494.9
Scaled : 475.6

13                     535.7
Scaled : 514.8
14                     538.6
Scaled : 517.6
15                     590.1
Scaled : 567.1

16                     649.7
Scaled : 624.3
17                     686.1
Scaled : 659.3
18                     767.2
Scaled : 737.3

19                     776.5
Scaled : 746.2
20                     811.2
Scaled : 779.5
21                     833.4
Scaled : 800.9

22                     842.0
Scaled : 809.2
23                     897.4
Scaled : 862.4
24                     907.1
Scaled : 871.7

25                     934.0
Scaled : 897.6
26                     969.7
Scaled : 931.9
27                     970.6
Scaled : 932.7

28                     981.5
Scaled : 943.3
29                     1024.5
Scaled : 984.6
30                     1033.0
Scaled : 992.7

31                     1066.0
Scaled : 1024.5
32                     1066.8
Scaled : 1025.2
33                     1159.5
Scaled : 1114.3

34                     1179.2
Scaled : 1133.2
35                     1196.7
Scaled : 1150.0
36                     1205.8
Scaled : 1158.8

37                     1251.4
Scaled : 1202.6
38                     1287.3
Scaled : 1237.1
39                     1296.7
Scaled : 1246.2

40                     1379.2
Scaled : 1325.4
41                     1417.8
Scaled : 1362.5
42                     1421.7
Scaled : 1366.2

43                     1428.1
Scaled : 1372.4
44                     1428.2
Scaled : 1372.5
45                     1446.2
Scaled : 1389.8

46                     1496.5
Scaled : 1438.1
47                     1496.5
Scaled : 1438.1
48                     1501.8
Scaled : 1443.2

49                     1511.8
Scaled : 1452.9
50                     1530.4
Scaled : 1470.7
51                     1554.5
Scaled : 1493.9

52                     1623.5
Scaled : 1560.2
53                     1669.3
Scaled : 1604.2
54                     1691.7
Scaled : 1625.7

55                     3035.6
Scaled : 2917.2
56                     3035.9
Scaled : 2917.5
57                     3088.8
Scaled : 2968.4

58                     3088.9
Scaled : 2968.4
59                     3125.5
Scaled : 3003.7
60                     3125.6
Scaled : 3003.7

61                     3166.1
Scaled : 3042.7
62                     3166.3
Scaled : 3042.8
63                     3169.0
Scaled : 3045.4

64                     3169.7
Scaled : 3046.1
65                     3186.7
Scaled : 3062.4
66                     3187.6
Scaled : 3063.2

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.