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)
-767.79023
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.02870 b
(cm-1)
0.00846 c
(cm-1)
0.00654
Dipole Moments
mu_x(Debye)
-0.17956 mu_y
(Debye)
-0.00356 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)
0.38400
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.10658
2
0.00000
0.00000
0.09602
3
0.00000
0.00000
-0.05935
4
0.00000
0.00000
-0.09041
5
0.00000
0.00000
-0.10710
6
0.00000
0.00000
-0.06783
7
0.00000
0.00000
0.00816
8
0.00000
0.00000
0.00275
9
0.00000
0.00000
0.01828
10
0.00000
0.00000
-0.00995
11
0.00000
0.00000
-0.05422
12
0.00000
0.00000
0.02094
13
0.00000
0.00000
0.01111
14
0.00000
0.00000
0.01918
15
0.00000
0.00000
0.06490
16
0.00000
0.00000
-0.04711
17
0.00000
0.00000
0.03422
18
0.00000
0.00000
-0.01771
19
0.00000
0.00000
0.03908
20
0.00000
0.00000
-0.02473
21
0.00000
0.00000
0.06920
22
0.00000
0.00000
0.07861
23
0.00000
0.00000
0.16340
24
0.00000
0.00000
0.06147
25
0.00000
0.00000
0.25389
26
0.00000
0.00000
0.08277
27
0.00000
0.00000
0.22939
28
0.00000
0.00000
0.09039
29
0.00000
0.00000
-0.04063
30
0.00000
0.00000
-0.14602
31
0.00000
0.00000
0.05184
32
0.00000
0.00000
-0.21339