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
0.11103
2
0.00000
0.00000
-0.11103
3
0.00000
0.00000
-0.09321
4
0.00000
0.00000
0.06918
5
0.00000
0.00000
-0.06918
6
0.00000
0.00000
0.09321
7
0.00000
0.00000
0.04364
8
0.00000
0.00000
0.00634
9
0.00000
0.00000
-0.00634
10
0.00000
0.00000
-0.04364
11
0.00000
0.00000
0.04293
12
0.00000
0.00000
-0.04133
13
0.00000
0.00000
0.04133
14
0.00000
0.00000
-0.04293
15
0.00000
0.00000
0.00512
16
0.00000
0.00000
-0.00512
17
0.00000
0.00000
-0.01714
18
0.00000
0.00000
0.01714
19
0.00000
0.00000
0.00518
20
0.00000
0.00000
-0.00518
21
0.00000
0.00000
-0.01843
22
0.00000
0.00000
0.01843
23
0.00000
0.00000
-0.20668
24
0.00000
0.00000
0.20668
25
0.00000
0.00000
0.00993
26
0.00000
0.00000
-0.00993
27
0.00000
0.00000
0.07332
28
0.00000
0.00000
-0.07332
29
0.00000
0.00000
-0.10822
30
0.00000
0.00000
0.10822
31
0.00000
0.00000
0.23390
32
0.00000
0.00000
-0.23390
33
0.00000
0.00000
0.02620
34
0.00000
0.00000
-0.02620