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)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.02230
2
0.00000
0.00000
0.02230
3
0.00000
0.00000
0.05098
4
0.00000
0.00000
0.02219
5
0.00000
0.00000
-0.02219
6
0.00000
0.00000
-0.05098
7
0.00000
0.00000
-0.05979
8
0.00000
0.00000
0.00356
9
0.00000
0.00000
-0.00356
10
0.00000
0.00000
0.05979
11
0.00000
0.00000
-0.07565
12
0.00000
0.00000
-0.04227
13
0.00000
0.00000
0.04227
14
0.00000
0.00000
0.07565
15
0.00000
0.00000
0.05351
16
0.00000
0.00000
-0.05351
17
0.00000
0.00000
0.01986
18
0.00000
0.00000
-0.01986
19
0.00000
0.00000
0.01549
20
0.00000
0.00000
-0.01549
21
0.00000
0.00000
0.05313
22
0.00000
0.00000
-0.05313
23
0.00000
0.00000
-0.23991
24
0.00000
0.00000
0.23991
25
0.00000
0.00000
-0.00095
26
0.00000
0.00000
0.00096
27
0.00000
0.00000
-0.23852
28
0.00000
0.00000
0.23852
29
0.00000
0.00000
-0.29426
30
0.00000
0.00000
0.29426
31
0.00000
0.00000
-0.04527
32
0.00000
0.00000
0.04527
33
0.00000
0.00000
-0.20711
34
0.00000
0.00000
0.20711