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)
0.00000
Eigenvectors
#
X
Y
Z
1
0.09340
0.02562
0.00000
2
-0.09340
-0.02563
0.00000
3
-0.00705
-0.06590
0.00000
4
0.06313
-0.01052
0.00000
5
-0.06313
0.01052
0.00000
6
0.00705
0.06590
0.00000
7
-0.00448
0.04840
0.00000
8
0.00034
-0.02437
0.00000
9
-0.00034
0.02436
0.00000
10
0.00448
-0.04840
0.00000
11
-0.05641
0.01890
0.00000
12
0.00244
0.06715
0.00000
13
-0.00244
-0.06715
0.00000
14
0.05641
-0.01890
0.00000
15
0.05530
0.05673
0.00000
16
-0.05530
-0.05673
0.00000
17
0.03612
0.01055
0.00000
18
-0.03612
-0.01055
0.00000
19
-0.02706
0.00382
0.00000
20
0.02706
-0.00382
0.00000
21
0.01239
-0.02746
0.00000
22
-0.01240
0.02746
0.00000
23
-0.07602
-0.05650
0.00000
24
0.07602
0.05650
0.00000
25
-0.10642
-0.11916
0.00000
26
0.10642
0.11916
0.00000
27
0.03598
-0.01813
0.00000
28
-0.03598
0.01813
0.00000
29
-0.02076
0.00461
0.00000
30
0.02076
-0.00461
0.00000
31
0.00573
-0.01475
0.00000
32
-0.00573
0.01476
0.00000
33
-0.00625
0.06394
0.00000
34
0.00625
-0.06394
0.00000