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)
1.49700
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00153
2
0.00000
0.00000
0.00153
3
0.00000
0.00000
-0.01145
4
0.00000
0.00000
0.04602
5
0.00000
0.00000
0.04602
6
0.00000
0.00000
-0.01145
7
0.00000
0.00000
0.03025
8
0.00000
0.00000
-0.07881
9
0.00000
0.00000
-0.07881
10
0.00000
0.00000
0.03025
11
0.00000
0.00000
0.03996
12
0.00000
0.00000
-0.03006
13
0.00000
0.00000
-0.03006
14
0.00000
0.00000
0.03996
15
0.00000
0.00000
-0.03065
16
0.00000
0.00000
-0.03065
17
0.00000
0.00000
-0.04888
18
0.00000
0.00000
-0.04888
19
0.00000
0.00000
-0.01179
20
0.00000
0.00000
-0.01179
21
0.00000
0.00000
0.01606
22
0.00000
0.00000
0.01606
23
0.00000
0.00000
0.16351
24
0.00000
0.00000
0.16351
25
0.00000
0.00000
0.23862
26
0.00000
0.00000
0.23862
27
0.00000
0.00000
0.13193
28
0.00000
0.00000
0.13193
29
0.00000
0.00000
0.13107
30
0.00000
0.00000
0.13107
31
0.00000
0.00000
0.41167
32
0.00000
0.00000
0.41167
33
0.00000
0.00000
-0.15031
34
0.00000
0.00000
-0.15032