Charge: 2
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/q+2
Electronic States
Energy
(eV)
-844.32045
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2h
Symmetry Elements
E
C2(z)
sigmah(xy)
i
Rotational Constants
(cm-1)
0.02100 b
(cm-1)
0.00820 c
(cm-1)
0.00590
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
0.00000
0.00000
0.00643
2
0.00000
0.00000
-0.00643
3
0.00000
0.00000
-0.00576
4
0.00000
0.00000
0.04351
5
0.00000
0.00000
-0.04351
6
0.00000
0.00000
0.00576
7
0.00000
0.00000
0.02476
8
0.00000
0.00000
-0.08556
9
0.00000
0.00000
0.08556
10
0.00000
0.00000
-0.02476
11
0.00000
0.00000
0.01876
12
0.00000
0.00000
-0.00531
13
0.00000
0.00000
0.00531
14
0.00000
0.00000
-0.01876
15
0.00000
0.00000
0.01419
16
0.00000
0.00000
-0.01419
17
0.00000
0.00000
-0.04710
18
0.00000
0.00000
0.04710
19
0.00000
0.00000
-0.01005
20
0.00000
0.00000
0.01005
21
0.00000
0.00000
0.03137
22
0.00000
0.00000
-0.03137
23
0.00000
0.00000
-0.14649
24
0.00000
0.00000
0.14649
25
0.00000
0.00000
0.25268
26
0.00000
0.00000
-0.25268
27
0.00000
0.00000
0.09606
28
0.00000
0.00000
-0.09606
29
0.00000
0.00000
0.04319
30
0.00000
0.00000
-0.04319
31
0.00000
0.00000
-0.43551
32
0.00000
0.00000
0.43551
33
0.00000
0.00000
-0.21422
34
0.00000
0.00000
0.21422