Vibrational Modes of 1,8 dimethyl naphthalene


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


Scale Factor : 0.961


Frequency unit : 1/cm

 


1                     45.4
Scaled : 43.6
2                     124.3
Scaled : 119.5
3                     159.2
Scaled : 153.0

4                     239.3
Scaled : 230.0
5                     242.8
Scaled : 233.3
6                     315.5
Scaled : 303.2

7                     324.1
Scaled : 311.5
8                     327.4
Scaled : 314.6
9                     461.1
Scaled : 443.2

10                     473.9
Scaled : 455.4
11                     485.3
Scaled : 466.3
12                     487.1
Scaled : 468.1

13                     523.9
Scaled : 503.5
14                     562.6
Scaled : 540.7
15                     586.4
Scaled : 563.5

16                     628.7
Scaled : 604.2
17                     636.2
Scaled : 611.4
18                     769.0
Scaled : 739.1

19                     785.3
Scaled : 754.6
20                     798.9
Scaled : 767.8
21                     811.8
Scaled : 780.2

22                     827.0
Scaled : 794.8
23                     896.4
Scaled : 861.5
24                     917.0
Scaled : 881.2

25                     962.5
Scaled : 924.9
26                     971.7
Scaled : 933.8
27                     983.3
Scaled : 944.9

28                     1008.4
Scaled : 969.0
29                     1054.0
Scaled : 1012.9
30                     1060.7
Scaled : 1019.3

31                     1068.6
Scaled : 1026.9
32                     1069.2
Scaled : 1027.5
33                     1141.9
Scaled : 1097.3

34                     1143.7
Scaled : 1099.1
35                     1189.7
Scaled : 1143.3
36                     1197.0
Scaled : 1150.3

37                     1246.4
Scaled : 1197.7
38                     1264.4
Scaled : 1215.1
39                     1290.4
Scaled : 1240.1

40                     1378.8
Scaled : 1325.0
41                     1381.9
Scaled : 1328.0
42                     1407.3
Scaled : 1352.4

43                     1421.5
Scaled : 1366.1
44                     1437.1
Scaled : 1381.0
45                     1473.4
Scaled : 1416.0

46                     1488.4
Scaled : 1430.4
47                     1494.2
Scaled : 1436.0
48                     1502.6
Scaled : 1444.0

49                     1518.5
Scaled : 1459.3
50                     1534.6
Scaled : 1474.8
51                     1561.8
Scaled : 1500.9

52                     1637.7
Scaled : 1573.8
53                     1659.1
Scaled : 1594.4
54                     1670.0
Scaled : 1604.9

55                     3052.3
Scaled : 2933.3
56                     3063.3
Scaled : 2943.9
57                     3114.0
Scaled : 2992.5

58                     3123.3
Scaled : 3001.5
59                     3130.1
Scaled : 3008.1
60                     3132.3
Scaled : 3010.1

61                     3173.1
Scaled : 3049.4
62                     3173.9
Scaled : 3050.1
63                     3179.6
Scaled : 3055.6

64                     3182.9
Scaled : 3058.8
65                     3201.1
Scaled : 3076.3
66                     3202.5
Scaled : 3077.6

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.