Charge: -1
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-1
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)
-0.75800
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00052
0.00000
0.00640
2
0.00052
0.00000
-0.00640
3
0.00780
0.00000
0.03604
4
-0.02293
0.00000
0.03149
5
0.00780
0.00000
-0.03604
6
-0.02293
0.00000
-0.03149
7
-0.04365
0.00000
-0.04772
8
0.06503
0.00000
-0.03668
9
-0.04365
0.00000
0.04772
10
0.06503
0.00000
0.03668
11
0.05727
0.00000
0.03634
12
-0.03333
0.00000
0.03893
13
0.05727
0.00000
-0.03634
14
-0.03333
0.00000
-0.03893
15
-0.02228
0.00000
-0.00257
16
0.01109
0.00000
-0.09242
17
-0.02228
0.00000
0.00257
18
0.01109
0.00000
0.09242
19
0.01733
0.00000
0.02531
20
0.01733
0.00000
-0.02531
21
-0.00987
0.00000
-0.06392
22
-0.00987
0.00000
0.06392
23
-0.02780
0.00000
-0.04594
24
0.00698
0.00000
0.19366
25
-0.02780
0.00000
0.04594
26
0.00698
0.00000
-0.19366
27
-0.12760
0.00000
-0.06868
28
0.00034
0.00000
0.06741
29
-0.12760
0.00000
0.06868
30
0.00034
0.00000
-0.06741
31
-0.12804
0.00000
0.06704
32
-0.12804
0.00000
-0.06704
33
-0.04502
0.00000
-0.00890
34
-0.04502
0.00000
0.00890