Charge: 2
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/q+2
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)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.07071
2
0.00000
0.00000
-0.07071
3
0.00000
0.00000
-0.06241
4
0.00000
0.00000
-0.10419
5
0.00000
0.00000
0.10419
6
0.00000
0.00000
0.06241
7
0.00000
0.00000
-0.06740
8
0.00000
0.00000
0.04422
9
0.00000
0.00000
-0.04422
10
0.00000
0.00000
0.06740
11
0.00000
0.00000
0.03272
12
0.00000
0.00000
0.03898
13
0.00000
0.00000
-0.03898
14
0.00000
0.00000
-0.03272
15
0.00000
0.00000
0.02356
16
0.00000
0.00000
-0.02356
17
0.00000
0.00000
0.00429
18
0.00000
0.00000
-0.00429
19
0.00000
0.00000
-0.02672
20
0.00000
0.00000
0.02672
21
0.00000
0.00000
0.02873
22
0.00000
0.00000
-0.02873
23
0.00000
0.00000
-0.02557
24
0.00000
0.00000
0.02557
25
0.00000
0.00000
0.02782
26
0.00000
0.00000
-0.02782
27
0.00000
0.00000
-0.02440
28
0.00000
0.00000
0.02440
29
0.00000
0.00000
-0.18763
30
0.00000
0.00000
0.18763
31
0.00000
0.00000
-0.26916
32
0.00000
0.00000
0.26916
33
0.00000
0.00000
0.13390
34
0.00000
0.00000
-0.13390