Charge: 2
Inchi:1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H/q+2
Electronic States
Energy
(eV)
-768.18063
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.02857 b
(cm-1)
0.00852 c
(cm-1)
0.00656
Dipole Moments
mu_x(Debye)
-0.12448 mu_y
(Debye)
-0.13148 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)
-0.22700
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.12078
2
0.00000
0.00000
0.07655
3
0.00000
0.00000
-0.01436
4
0.00000
0.00000
0.07951
5
0.00000
0.00000
-0.05291
6
0.00000
0.00000
0.02090
7
0.00000
0.00000
0.05850
8
0.00000
0.00000
-0.08249
9
0.00000
0.00000
0.09908
10
0.00000
0.00000
-0.09469
11
0.00000
0.00000
0.03891
12
0.00000
0.00000
0.01524
13
0.00000
0.00000
-0.01503
14
0.00000
0.00000
0.03742
15
0.00000
0.00000
0.02790
16
0.00000
0.00000
-0.02932
17
0.00000
0.00000
-0.01079
18
0.00000
0.00000
0.00628
19
0.00000
0.00000
0.00657
20
0.00000
0.00000
-0.01507
21
0.00000
0.00000
0.14923
22
0.00000
0.00000
-0.23281
23
0.00000
0.00000
0.26333
24
0.00000
0.00000
-0.20561
25
0.00000
0.00000
-0.05966
26
0.00000
0.00000
0.01171
27
0.00000
0.00000
0.02577
28
0.00000
0.00000
-0.12201
29
0.00000
0.00000
-0.01466
30
0.00000
0.00000
-0.02137
31
0.00000
0.00000
-0.09430
32
0.00000
0.00000
-0.07366