Charge: 0
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
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)
-0.31800
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00857
2
0.00000
0.00000
-0.00211
3
0.00000
0.00000
-0.11673
4
0.00000
0.00000
0.10747
5
0.00000
0.00000
0.10579
6
0.00000
0.00000
-0.10936
7
0.00000
0.00000
0.05719
8
0.00000
0.00000
-0.05731
9
0.00000
0.00000
-0.05926
10
0.00000
0.00000
0.05625
11
0.00000
0.00000
-0.02088
12
0.00000
0.00000
-0.00413
13
0.00000
0.00000
-0.00516
14
0.00000
0.00000
0.00660
15
0.00000
0.00000
0.03117
16
0.00000
0.00000
-0.00695
17
0.00000
0.00000
0.03500
18
0.00000
0.00000
-0.00938
19
0.00000
0.00000
0.02030
20
0.00000
0.00000
-0.01003
21
0.00000
0.00000
0.20277
22
0.00000
0.00000
-0.19189
23
0.00000
0.00000
-0.18360
24
0.00000
0.00000
0.19647
25
0.00000
0.00000
-0.07136
26
0.00000
0.00000
-0.14655
27
0.00000
0.00000
0.12770
28
0.00000
0.00000
0.02103
29
0.00000
0.00000
-0.03778
30
0.00000
0.00000
-0.12507
31
0.00000
0.00000
-0.03298
32
0.00000
0.00000
-0.08084