Vibrational Modes of 2,7 dimethyl naphthalene


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


Scale Factor : 0.961


Frequency unit : 1/cm

 


1                     88.0
Scaled : 84.6
2                     95.7
Scaled : 92.0
3                     119.4
Scaled : 114.8

4                     132.5
Scaled : 127.4
5                     218.3
Scaled : 209.8
6                     282.2
Scaled : 271.2

7                     285.6
Scaled : 274.5
8                     329.2
Scaled : 316.3
9                     418.9
Scaled : 402.6

10                     426.3
Scaled : 409.6
11                     448.7
Scaled : 431.2
12                     472.7
Scaled : 454.3

13                     491.5
Scaled : 472.4
14                     553.9
Scaled : 532.3
15                     644.7
Scaled : 619.6

16                     649.9
Scaled : 624.6
17                     689.8
Scaled : 662.9
18                     778.3
Scaled : 748.0

19                     779.3
Scaled : 748.9
20                     790.4
Scaled : 759.6
21                     798.8
Scaled : 767.7

22                     854.2
Scaled : 820.9
23                     876.6
Scaled : 842.4
24                     918.8
Scaled : 883.0

25                     956.6
Scaled : 919.3
26                     963.7
Scaled : 926.1
27                     971.7
Scaled : 933.8

28                     973.6
Scaled : 935.6
29                     1015.9
Scaled : 976.3
30                     1046.8
Scaled : 1006.0

31                     1065.9
Scaled : 1024.3
32                     1067.5
Scaled : 1025.8
33                     1164.0
Scaled : 1118.6

34                     1181.8
Scaled : 1135.7
35                     1203.8
Scaled : 1156.8
36                     1204.2
Scaled : 1157.2

37                     1241.7
Scaled : 1193.2
38                     1284.3
Scaled : 1234.2
39                     1297.3
Scaled : 1246.7

40                     1376.4
Scaled : 1322.7
41                     1418.9
Scaled : 1363.6
42                     1420.8
Scaled : 1365.4

43                     1427.6
Scaled : 1372.0
44                     1429.1
Scaled : 1373.3
45                     1460.1
Scaled : 1403.2

46                     1496.9
Scaled : 1438.6
47                     1497.0
Scaled : 1438.6
48                     1497.3
Scaled : 1438.9

49                     1514.4
Scaled : 1455.3
50                     1516.8
Scaled : 1457.6
51                     1562.9
Scaled : 1501.9

52                     1622.7
Scaled : 1559.4
53                     1669.6
Scaled : 1604.5
54                     1691.1
Scaled : 1625.2

55                     3035.6
Scaled : 2917.2
56                     3035.8
Scaled : 2917.4
57                     3088.8
Scaled : 2968.3

58                     3088.9
Scaled : 2968.4
59                     3125.6
Scaled : 3003.7
60                     3125.7
Scaled : 3003.8

61                     3166.7
Scaled : 3043.2
62                     3168.0
Scaled : 3044.5
63                     3169.6
Scaled : 3046.0

64                     3170.7
Scaled : 3047.1
65                     3186.5
Scaled : 3062.2
66                     3188.9
Scaled : 3064.5

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.