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)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.11600
Eigenvectors
#
X
Y
Z
1
0.05797
0.00000
-0.01979
2
-0.05797
0.00000
-0.01979
3
0.01662
0.00000
0.01115
4
-0.01040
0.00000
-0.05333
5
-0.01662
0.00000
0.01115
6
0.01040
0.00000
-0.05333
7
0.04251
0.00000
0.03311
8
-0.00177
0.00000
-0.05103
9
-0.04251
0.00000
0.03311
10
0.00177
0.00000
-0.05103
11
0.05845
0.00000
0.01791
12
-0.00578
0.00000
-0.01394
13
-0.05845
0.00000
0.01791
14
0.00578
0.00000
-0.01394
15
0.09525
0.00000
0.00108
16
-0.05895
0.00000
0.01457
17
-0.09525
0.00000
0.00108
18
0.05895
0.00000
0.01457
19
0.00323
0.00000
0.05953
20
-0.00323
0.00000
0.05953
21
0.08219
0.00000
-0.00285
22
-0.08219
0.00000
-0.00285
23
0.09592
0.00000
-0.01157
24
-0.06007
0.00000
0.05305
25
-0.09592
0.00000
-0.01157
26
0.06007
0.00000
0.05305
27
0.03380
0.00000
0.00331
28
0.03362
0.00000
0.00985
29
-0.03380
0.00000
0.00331
30
-0.03362
0.00000
0.00985
31
0.00902
0.00000
-0.05663
32
-0.00902
0.00000
-0.05663
33
-0.02143
0.00000
0.04484
34
0.02143
0.00000
0.04484