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)
-844.57197
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2h
Symmetry Elements
E
C2(z)
sigmah(xy)
i
Rotational Constants
(cm-1)
0.02099 b
(cm-1)
0.00812 c
(cm-1)
0.00585
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
-0.05982
2
0.00000
0.00000
0.05982
3
0.00000
0.00000
0.02602
4
0.00000
0.00000
-0.06727
5
0.00000
0.00000
0.06727
6
0.00000
0.00000
-0.02602
7
0.00000
0.00000
0.02734
8
0.00000
0.00000
0.00435
9
0.00000
0.00000
-0.00435
10
0.00000
0.00000
-0.02734
11
0.00000
0.00000
0.00109
12
0.00000
0.00000
0.04637
13
0.00000
0.00000
-0.04637
14
0.00000
0.00000
-0.00109
15
0.00000
0.00000
-0.02506
16
0.00000
0.00000
0.02506
17
0.00000
0.00000
0.03358
18
0.00000
0.00000
-0.03358
19
0.00000
0.00000
-0.01143
20
0.00000
0.00000
0.01143
21
0.00000
0.00000
-0.06602
22
0.00000
0.00000
0.06602
23
0.00000
0.00000
0.25643
24
0.00000
0.00000
-0.25643
25
0.00000
0.00000
-0.20134
26
0.00000
0.00000
0.20134
27
0.00000
0.00000
0.09276
28
0.00000
0.00000
-0.09276
29
0.00000
0.00000
0.16990
30
0.00000
0.00000
-0.16990
31
0.00000
0.00000
-0.03859
32
0.00000
0.00000
0.03859
33
0.00000
0.00000
0.37042
34
0.00000
0.00000
-0.37042