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)
0.88200
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.01672
0.00000
0.10428
2
-0.01672
0.00000
-0.10428
3
-0.00555
0.00000
-0.08448
4
0.02095
0.00000
0.07815
5
-0.00555
0.00000
0.08448
6
0.02095
0.00000
-0.07815
7
-0.00431
0.00000
0.03660
8
-0.03316
0.00000
-0.01983
9
-0.00431
0.00000
-0.03660
10
-0.03316
0.00000
0.01983
11
-0.00983
0.00000
-0.02888
12
0.04921
0.00000
0.03311
13
-0.00983
0.00000
0.02888
14
0.04921
0.00000
-0.03311
15
0.00288
0.00000
0.04366
16
-0.02047
0.00000
-0.03842
17
0.00288
0.00000
-0.04366
18
-0.02047
0.00000
0.03842
19
0.00008
0.00000
-0.00720
20
0.00008
0.00000
0.00720
21
0.01857
0.00000
-0.05089
22
0.01857
0.00000
0.05089
23
0.00342
0.00000
-0.07617
24
-0.02352
0.00000
0.05527
25
0.00342
0.00000
0.07617
26
-0.02352
0.00000
-0.05527
27
0.05213
0.00000
0.00424
28
-0.09775
0.00000
-0.05506
29
0.05213
0.00000
-0.00424
30
-0.09775
0.00000
0.05506
31
0.05042
0.00000
-0.06926
32
0.05042
0.00000
0.06926
33
-0.00437
0.00000
-0.00920
34
-0.00437
0.00000
0.00920