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)
0.40700
Eigenvectors
#
X
Y
Z
1
-0.01013
0.00000
-0.02754
2
0.01013
0.00000
-0.02754
3
0.12056
0.00000
0.02253
4
-0.00172
0.00000
-0.00915
5
-0.12056
0.00000
0.02253
6
0.00172
0.00000
-0.00915
7
-0.01568
0.00000
-0.00927
8
-0.03233
0.00000
0.03514
9
0.01568
0.00000
-0.00927
10
0.03233
0.00000
0.03514
11
-0.01262
0.00000
-0.01916
12
-0.01280
0.00000
-0.01545
13
0.01262
0.00000
-0.01916
14
0.01280
0.00000
-0.01545
15
0.02788
0.00000
0.02583
16
-0.00317
0.00000
-0.04337
17
-0.02788
0.00000
0.02583
18
0.00317
0.00000
-0.04337
19
-0.05106
0.00000
-0.00225
20
0.05106
0.00000
-0.00225
21
-0.04548
0.00000
0.02875
22
0.04548
0.00000
0.02875
23
0.03014
0.00000
-0.13279
24
-0.00393
0.00000
0.21287
25
-0.03014
0.00000
-0.13279
26
0.00393
0.00000
0.21287
27
0.02535
0.00000
0.00000
28
0.16270
0.00000
0.08891
29
-0.02535
0.00000
0.00000
30
-0.16270
0.00000
0.08891
31
0.19958
0.00000
-0.08404
32
-0.19958
0.00000
-0.08404
33
0.07705
0.00000
0.08102
34
-0.07705
0.00000
0.08102