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
0.02860
0.04918
0.00000
2
-0.02860
-0.04918
0.00000
3
-0.03552
-0.01223
0.00000
4
0.01020
0.03752
0.00000
5
-0.01020
-0.03752
0.00000
6
0.03552
0.01223
0.00000
7
0.00044
-0.02183
0.00000
8
0.00472
-0.04031
0.00000
9
-0.00472
0.04031
0.00000
10
-0.00044
0.02183
0.00000
11
0.04088
0.00373
0.00000
12
0.00876
0.05410
0.00000
13
-0.00876
-0.05410
0.00000
14
-0.04088
-0.00373
0.00000
15
0.00642
0.04864
0.00000
16
-0.00642
-0.04864
0.00000
17
0.00080
-0.03168
0.00000
18
-0.00080
0.03168
0.00000
19
-0.08283
0.02205
0.00000
20
0.08283
-0.02205
0.00000
21
0.02936
0.03745
0.00000
22
-0.02936
-0.03745
0.00000
23
-0.08187
-0.02013
0.00000
24
0.08187
0.02013
0.00000
25
0.13839
0.08400
0.00000
26
-0.13839
-0.08400
0.00000
27
0.28986
-0.10121
0.00000
28
-0.28986
0.10121
0.00000
29
-0.04377
0.07995
0.00000
30
0.04377
-0.07995
0.00000
31
0.02509
-0.08640
0.00000
32
-0.02509
0.08640
0.00000
33
0.08303
-0.18904
0.00000
34
-0.08303
0.18904
0.00000