Charge: 2
Inchi:1S/C22H12/c1-3-13-7-9-15-11-12-16-10-8-14-4-2-6-18-17(5-1)19(13)21(15)22(16)20(14)18/h1-12H/q+2
Electronic States
Energy
(eV)
-844.31798
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-0.27800
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00053
0.00000
0.00013
2
0.00053
0.00000
-0.00013
3
-0.00015
0.00000
0.00000
4
-0.00004
0.00000
0.00002
5
-0.00015
0.00000
0.00000
6
-0.00004
0.00000
-0.00002
7
-0.00026
0.00000
-0.00015
8
0.00058
0.00000
0.00117
9
-0.00026
0.00000
0.00015
10
0.00058
0.00000
-0.00117
11
0.00612
0.00000
-0.01076
12
0.01077
0.00000
-0.01483
13
0.00612
0.00000
0.01076
14
0.01077
0.00000
0.01483
15
-0.00821
0.00000
0.00032
16
-0.05335
0.00000
-0.00066
17
-0.00821
0.00000
-0.00032
18
-0.05335
0.00000
0.00066
19
-0.00152
0.00000
0.00288
20
-0.00152
0.00000
-0.00288
21
0.00055
0.00000
0.00147
22
0.00055
0.00000
-0.00147
23
0.09754
0.00000
-0.00248
24
0.61211
0.00000
0.00826
25
0.09754
0.00000
0.00248
26
0.61211
0.00000
-0.00826
27
-0.07038
0.00000
0.12294
28
-0.11458
0.00000
0.19036
29
-0.07038
0.00000
-0.12294
30
-0.11458
0.00000
-0.19036
31
-0.00857
0.00000
-0.01329
32
-0.00857
0.00000
0.01329
33
0.01932
0.00000
-0.03304
34
0.01932
0.00000
0.03304