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)
-0.04500
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00128
0.00000
0.03677
2
0.00128
0.00000
-0.03677
3
0.08224
0.00000
0.01803
4
-0.07486
0.00000
-0.00001
5
0.08224
0.00000
-0.01803
6
-0.07486
0.00000
0.00001
7
-0.01471
0.00000
-0.00232
8
0.03371
0.00000
0.04548
9
-0.01471
0.00000
0.00232
10
0.03371
0.00000
-0.04548
11
-0.05641
0.00000
0.04181
12
0.04475
0.00000
-0.04717
13
-0.05641
0.00000
-0.04181
14
0.04475
0.00000
0.04717
15
0.05520
0.00000
-0.01945
16
-0.07376
0.00000
0.00458
17
0.05520
0.00000
0.01945
18
-0.07376
0.00000
-0.00458
19
0.01184
0.00000
-0.03648
20
0.01184
0.00000
0.03648
21
-0.00469
0.00000
-0.01673
22
-0.00469
0.00000
0.01673
23
0.05647
0.00000
-0.09993
24
-0.07669
0.00000
0.07513
25
0.05647
0.00000
0.09993
26
-0.07669
0.00000
-0.07513
27
-0.12492
0.00000
0.00364
28
0.06932
0.00000
-0.03326
29
-0.12492
0.00000
-0.00364
30
0.06932
0.00000
0.03326
31
0.03306
0.00000
0.04490
32
0.03306
0.00000
-0.04490
33
-0.01203
0.00000
-0.05119
34
-0.01203
0.00000
0.05119