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)
-0.16400
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.03056
2
0.00000
0.00000
0.08246
3
0.00000
0.00000
-0.05914
4
0.00000
0.00000
-0.01621
5
0.00000
0.00000
-0.03615
6
0.00000
0.00000
-0.01867
7
0.00000
0.00000
0.00964
8
0.00000
0.00000
0.01372
9
0.00000
0.00000
0.01703
10
0.00000
0.00000
0.01070
11
0.00000
0.00000
-0.03644
12
0.00000
0.00000
-0.06470
13
0.00000
0.00000
-0.04285
14
0.00000
0.00000
-0.06411
15
0.00000
0.00000
0.10825
16
0.00000
0.00000
0.08900
17
0.00000
0.00000
-0.04723
18
0.00000
0.00000
0.08909
19
0.00000
0.00000
-0.08448
20
0.00000
0.00000
0.03902
21
0.00000
0.00000
0.07277
22
0.00000
0.00000
0.05234
23
0.00000
0.00000
0.05470
24
0.00000
0.00000
0.02767
25
0.00000
0.00000
-0.17263
26
0.00000
0.00000
-0.14407
27
0.00000
0.00000
-0.15932
28
0.00000
0.00000
0.18307
29
0.00000
0.00000
-0.23041
30
0.00000
0.00000
0.20443
31
0.00000
0.00000
-0.12974
32
0.00000
0.00000
0.00883