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)
-844.54925
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2h
Symmetry Elements
E
C2(z)
sigmah(xy)
i
Rotational Constants
(cm-1)
0.02091 b
(cm-1)
0.00821 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)
0.99400
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.04070
2
0.00000
0.00000
-0.04070
3
0.00000
0.00000
0.09147
4
0.00000
0.00000
0.01489
5
0.00000
0.00000
0.01489
6
0.00000
0.00000
0.09147
7
0.00000
0.00000
-0.02025
8
0.00000
0.00000
0.00798
9
0.00000
0.00000
0.00797
10
0.00000
0.00000
-0.02025
11
0.00000
0.00000
-0.04535
12
0.00000
0.00000
-0.00593
13
0.00000
0.00000
-0.00592
14
0.00000
0.00000
-0.04535
15
0.00000
0.00000
0.01940
16
0.00000
0.00000
0.01940
17
0.00000
0.00000
-0.01174
18
0.00000
0.00000
-0.01174
19
0.00000
0.00000
-0.05576
20
0.00000
0.00000
-0.05576
21
0.00000
0.00000
-0.02008
22
0.00000
0.00000
-0.02008
23
0.00000
0.00000
-0.03181
24
0.00000
0.00000
-0.03180
25
0.00000
0.00000
0.32896
26
0.00000
0.00000
0.32894
27
0.00000
0.00000
0.28541
28
0.00000
0.00000
0.28540
29
0.00000
0.00000
-0.06154
30
0.00000
0.00000
-0.06152
31
0.00000
0.00000
-0.04879
32
0.00000
0.00000
-0.04880
33
0.00000
0.00000
0.31433
34
0.00000
0.00000
0.31431