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)
-843.94190
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2h
Symmetry Elements
E
C2(z)
sigmah(xy)
i
Rotational Constants
(cm-1)
0.02102 b
(cm-1)
0.00818 c
(cm-1)
0.00589
Dipole Moments
mu_x(Debye)
0.00001 mu_y
(Debye)
-0.00001 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)
-0.53700
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.07314
2
0.00000
0.00000
-0.07314
3
0.00000
0.00000
0.02479
4
0.00000
0.00000
0.05602
5
0.00000
0.00000
0.05602
6
0.00000
0.00000
0.02479
7
0.00000
0.00000
-0.07766
8
0.00000
0.00000
0.01274
9
0.00000
0.00000
0.01274
10
0.00000
0.00000
-0.07766
11
0.00000
0.00000
0.12488
12
0.00000
0.00000
0.00405
13
0.00000
0.00000
0.00405
14
0.00000
0.00000
0.12488
15
0.00000
0.00000
-0.02820
16
0.00000
0.00000
-0.02820
17
0.00000
0.00000
-0.03580
18
0.00000
0.00000
-0.03580
19
0.00000
0.00000
0.02679
20
0.00000
0.00000
0.02679
21
0.00000
0.00000
0.00086
22
0.00000
0.00000
0.00086
23
0.00000
0.00000
-0.18893
24
0.00000
0.00000
-0.18893
25
0.00000
0.00000
-0.21991
26
0.00000
0.00000
-0.21991
27
0.00000
0.00000
0.00218
28
0.00000
0.00000
0.00218
29
0.00000
0.00000
-0.08535
30
0.00000
0.00000
-0.08535
31
0.00000
0.00000
0.05744
32
0.00000
0.00000
0.05745
33
0.00000
0.00000
0.01386
34
0.00000
0.00000
0.01386