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)
-0.20000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.08652
0.00000
-0.00499
2
0.08652
0.00000
0.00499
3
-0.02646
0.00000
-0.00861
4
-0.04047
0.00000
0.00409
5
-0.02646
0.00000
0.00861
6
-0.04047
0.00000
-0.00409
7
-0.07774
0.00000
-0.02851
8
0.00122
0.00000
0.00272
9
-0.07774
0.00000
0.02851
10
0.00122
0.00000
-0.00272
11
0.01982
0.00000
-0.03579
12
-0.00583
0.00000
-0.01486
13
0.01982
0.00000
0.03579
14
-0.00583
0.00000
0.01486
15
0.00249
0.00000
0.01624
16
-0.02973
0.00000
0.01669
17
0.00249
0.00000
-0.01624
18
-0.02973
0.00000
-0.01669
19
0.00914
0.00000
0.00153
20
0.00914
0.00000
-0.00153
21
0.03221
0.00000
0.03265
22
0.03221
0.00000
-0.03265
23
0.00684
0.00000
0.19294
24
-0.03510
0.00000
0.29539
25
0.00684
0.00000
-0.19294
26
-0.03510
0.00000
-0.29539
27
0.09392
0.00000
-0.00077
28
-0.08334
0.00000
-0.06226
29
0.09392
0.00000
0.00077
30
-0.08334
0.00000
0.06226
31
0.18051
0.00000
-0.09376
32
0.18051
0.00000
0.09376
33
0.18040
0.00000
0.10312
34
0.18040
0.00000
-0.10312