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)
0.00800
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00787
0.00000
0.07757
2
0.00787
0.00000
-0.07757
3
-0.04768
0.00000
0.07833
4
0.05581
0.00000
-0.02321
5
-0.04768
0.00000
-0.07833
6
0.05581
0.00000
0.02321
7
-0.01038
0.00000
0.01579
8
0.04272
0.00000
0.06944
9
-0.01038
0.00000
-0.01579
10
0.04272
0.00000
-0.06944
11
0.02858
0.00000
-0.03430
12
-0.03498
0.00000
0.02621
13
0.02858
0.00000
0.03430
14
-0.03498
0.00000
-0.02621
15
0.00609
0.00000
-0.00210
16
-0.04078
0.00000
-0.02153
17
0.00609
0.00000
0.00210
18
-0.04078
0.00000
0.02153
19
0.00668
0.00000
-0.06709
20
0.00668
0.00000
0.06709
21
-0.00294
0.00000
0.01784
22
-0.00294
0.00000
-0.01784
23
0.00764
0.00000
0.07220
24
-0.04372
0.00000
-0.10595
25
0.00764
0.00000
-0.07220
26
-0.04372
0.00000
0.10595
27
0.01050
0.00000
-0.04459
28
-0.10395
0.00000
-0.00928
29
0.01050
0.00000
0.04459
30
-0.10395
0.00000
0.00928
31
0.08852
0.00000
0.05532
32
0.08852
0.00000
-0.05532
33
-0.08977
0.00000
-0.12664
34
-0.08977
0.00000
0.12664