Charge: 2
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+2
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)
0.07400
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.05419
2
0.00000
0.00000
0.01133
3
0.00000
0.00000
0.00862
4
0.00000
0.00000
-0.03505
5
0.00000
0.00000
0.09800
6
0.00000
0.00000
-0.02151
7
0.00000
0.00000
0.04431
8
0.00000
0.00000
0.00691
9
0.00000
0.00000
0.00910
10
0.00000
0.00000
-0.09909
11
0.00000
0.00000
-0.07716
12
0.00000
0.00000
-0.06365
13
0.00000
0.00000
0.07336
14
0.00000
0.00000
0.05148
15
0.00000
0.00000
-0.06678
16
0.00000
0.00000
0.04144
17
0.00000
0.00000
-0.06992
18
0.00000
0.00000
0.06575
19
0.00000
0.00000
0.04482
20
0.00000
0.00000
-0.08539
21
0.00000
0.00000
0.07644
22
0.00000
0.00000
0.00942
23
0.00000
0.00000
-0.01012
24
0.00000
0.00000
-0.20837
25
0.00000
0.00000
-0.12717
26
0.00000
0.00000
0.12737
27
0.00000
0.00000
0.10066
28
0.00000
0.00000
0.08902
29
0.00000
0.00000
0.11918
30
0.00000
0.00000
0.16730
31
0.00000
0.00000
-0.10268
32
0.00000
0.00000
-0.13091