Charge: -1
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-1
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
0.06738
2
0.00000
0.00000
-0.06738
3
0.00000
0.00000
-0.03609
4
0.00000
0.00000
0.02714
5
0.00000
0.00000
-0.02714
6
0.00000
0.00000
0.03609
7
0.00000
0.00000
-0.01056
8
0.00000
0.00000
-0.02252
9
0.00000
0.00000
0.02252
10
0.00000
0.00000
0.01056
11
0.00000
0.00000
0.00388
12
0.00000
0.00000
0.01781
13
0.00000
0.00000
-0.01781
14
0.00000
0.00000
-0.00388
15
0.00000
0.00000
-0.03450
16
0.00000
0.00000
0.03450
17
0.00000
0.00000
0.04102
18
0.00000
0.00000
-0.04102
19
0.00000
0.00000
0.02837
20
0.00000
0.00000
-0.02837
21
0.00000
0.00000
0.04195
22
0.00000
0.00000
-0.04195
23
0.00000
0.00000
0.19423
24
0.00000
0.00000
-0.19423
25
0.00000
0.00000
-0.27177
26
0.00000
0.00000
0.27177
27
0.00000
0.00000
-0.33140
28
0.00000
0.00000
0.33140
29
0.00000
0.00000
0.22043
30
0.00000
0.00000
-0.22043
31
0.00000
0.00000
-0.09422
32
0.00000
0.00000
0.09422
33
0.00000
0.00000
-0.25064
34
0.00000
0.00000
0.25064