Charge: 0
Inchi:1S/C22H12/c1-3-13-7-9-18-12-16-6-2-4-14-8-10-17-11-15(5-1)19(13)21(18)22(17)20(14)16/h1-12H
Electronic States
Energy
(eV)
-844.57197
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2h
Symmetry Elements
E
C2(z)
sigmah(xy)
i
Rotational Constants
(cm-1)
0.02099 b
(cm-1)
0.00812 c
(cm-1)
0.00585
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.00000
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)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00251
-0.01852
0.00000
2
0.00251
0.01852
0.00000
3
-0.02494
0.00333
0.00000
4
-0.01827
0.05328
0.00000
5
0.01827
-0.05328
0.00000
6
0.02494
-0.00333
0.00000
7
0.01931
0.07090
0.00000
8
-0.00741
-0.00808
0.00000
9
0.00741
0.00808
0.00000
10
-0.01931
-0.07090
0.00000
11
-0.04115
-0.02972
0.00000
12
0.00918
-0.02185
0.00000
13
-0.00918
0.02185
0.00000
14
0.04115
0.02972
0.00000
15
0.00811
-0.01232
0.00000
16
-0.00811
0.01232
0.00000
17
-0.00160
0.00140
0.00000
18
0.00160
-0.00140
0.00000
19
0.00529
-0.00251
0.00000
20
-0.00529
0.00251
0.00000
21
-0.02742
-0.01374
0.00000
22
0.02742
0.01374
0.00000
23
0.05524
0.03100
0.00000
24
-0.05524
-0.03100
0.00000
25
0.03657
0.04194
0.00000
26
-0.03657
-0.04194
0.00000
27
0.13835
-0.04639
0.00000
28
-0.13835
0.04639
0.00000
29
-0.06821
0.30510
0.00000
30
0.06821
-0.30510
0.00000
31
-0.07732
0.42826
0.00000
32
0.07732
-0.42826
0.00000
33
-0.00921
-0.11705
0.00000
34
0.00921
0.11705
0.00000