Charge: 1
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+1
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)
-0.45000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.11436
2
0.00000
0.00000
-0.08885
3
0.00000
0.00000
0.06621
4
0.00000
0.00000
0.08890
5
0.00000
0.00000
0.10624
6
0.00000
0.00000
0.06183
7
0.00000
0.00000
-0.00093
8
0.00000
0.00000
0.00429
9
0.00000
0.00000
-0.01396
10
0.00000
0.00000
0.02169
11
0.00000
0.00000
0.03312
12
0.00000
0.00000
-0.03291
13
0.00000
0.00000
-0.01698
14
0.00000
0.00000
-0.03327
15
0.00000
0.00000
-0.04297
16
0.00000
0.00000
0.05973
17
0.00000
0.00000
-0.03882
18
0.00000
0.00000
0.02729
19
0.00000
0.00000
-0.04095
20
0.00000
0.00000
0.02768
21
0.00000
0.00000
-0.11036
22
0.00000
0.00000
-0.11158
23
0.00000
0.00000
-0.19008
24
0.00000
0.00000
-0.08660
25
0.00000
0.00000
-0.25992
26
0.00000
0.00000
-0.10287
27
0.00000
0.00000
-0.22552
28
0.00000
0.00000
-0.04518
29
0.00000
0.00000
0.00148
30
0.00000
0.00000
0.13400
31
0.00000
0.00000
-0.03562
32
0.00000
0.00000
0.16345