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)
-844.32045
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)
-1.96800
Diff mu Y
(Debye)
-0.42200
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00928
0.01549
0.00000
2
0.00928
0.01549
0.00000
3
-0.02277
0.01182
0.00000
4
0.01009
-0.04593
0.00000
5
0.01009
-0.04593
0.00000
6
-0.02277
0.01182
0.00000
7
0.00072
-0.01954
0.00000
8
0.00058
-0.00134
0.00000
9
0.00058
-0.00134
0.00000
10
0.00072
-0.01954
0.00000
11
-0.01315
-0.01931
0.00000
12
-0.00824
0.01560
0.00000
13
-0.00824
0.01560
0.00000
14
-0.01315
-0.01931
0.00000
15
-0.00561
-0.00327
0.00000
16
-0.00561
-0.00327
0.00000
17
-0.02561
-0.01052
0.00000
18
-0.02561
-0.01052
0.00000
19
0.04448
-0.01080
0.00000
20
0.04448
-0.01080
0.00000
21
-0.00963
0.02841
0.00000
22
-0.00963
0.02841
0.00000
23
0.07834
0.06471
0.00000
24
0.07834
0.06471
0.00000
25
-0.14094
-0.10578
0.00000
26
-0.14094
-0.10578
0.00000
27
0.41459
-0.13755
0.00000
28
0.41459
-0.13755
0.00000
29
-0.02721
0.14067
0.00000
30
-0.02721
0.14067
0.00000
31
-0.02493
0.17565
0.00000
32
-0.02493
0.17565
0.00000
33
-0.06330
0.33136
0.00000
34
-0.06330
0.33136
0.00000