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)
-844.54925
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)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.04245
2
0.00000
0.00000
-0.04245
3
0.00000
0.00000
-0.08971
4
0.00000
0.00000
-0.10060
5
0.00000
0.00000
0.10060
6
0.00000
0.00000
0.08971
7
0.00000
0.00000
-0.04186
8
0.00000
0.00000
0.03482
9
0.00000
0.00000
-0.03482
10
0.00000
0.00000
0.04186
11
0.00000
0.00000
0.03370
12
0.00000
0.00000
0.02993
13
0.00000
0.00000
-0.02993
14
0.00000
0.00000
-0.03370
15
0.00000
0.00000
0.02038
16
0.00000
0.00000
-0.02038
17
0.00000
0.00000
0.02554
18
0.00000
0.00000
-0.02554
19
0.00000
0.00000
-0.05527
20
0.00000
0.00000
0.05527
21
0.00000
0.00000
0.05057
22
0.00000
0.00000
-0.05057
23
0.00000
0.00000
-0.05439
24
0.00000
0.00000
0.05439
25
0.00000
0.00000
0.07394
26
0.00000
0.00000
-0.07394
27
0.00000
0.00000
-0.09540
28
0.00000
0.00000
0.09540
29
0.00000
0.00000
-0.17375
30
0.00000
0.00000
0.17375
31
0.00000
0.00000
-0.22104
32
0.00000
0.00000
0.22104
33
0.00000
0.00000
0.15085
34
0.00000
0.00000
-0.15084