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)
-768.43015
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.02846 b
(cm-1)
0.00844 c
(cm-1)
0.00651
Dipole Moments
mu_x(Debye)
0.18438 mu_y
(Debye)
0.13618 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)
-0.06400
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.05061
2
0.00000
0.00000
-0.07229
3
0.00000
0.00000
0.05797
4
0.00000
0.00000
0.01756
5
0.00000
0.00000
0.00907
6
0.00000
0.00000
-0.04642
7
0.00000
0.00000
0.01673
8
0.00000
0.00000
-0.01955
9
0.00000
0.00000
-0.00010
10
0.00000
0.00000
-0.00384
11
0.00000
0.00000
-0.08333
12
0.00000
0.00000
0.05993
13
0.00000
0.00000
-0.03343
14
0.00000
0.00000
0.07205
15
0.00000
0.00000
0.04007
16
0.00000
0.00000
-0.07981
17
0.00000
0.00000
-0.05855
18
0.00000
0.00000
0.09610
19
0.00000
0.00000
-0.09949
20
0.00000
0.00000
0.07263
21
0.00000
0.00000
-0.06457
22
0.00000
0.00000
-0.08577
23
0.00000
0.00000
0.02207
24
0.00000
0.00000
0.06759
25
0.00000
0.00000
0.09728
26
0.00000
0.00000
-0.09590
27
0.00000
0.00000
0.17794
28
0.00000
0.00000
-0.14802
29
0.00000
0.00000
-0.21420
30
0.00000
0.00000
0.22516
31
0.00000
0.00000
-0.02339
32
0.00000
0.00000
0.09066