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)
0.19500
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.00116
2
0.00000
0.00000
-0.00101
3
0.00000
0.00000
-0.00845
4
0.00000
0.00000
-0.03682
5
0.00000
0.00000
0.02277
6
0.00000
0.00000
0.04132
7
0.00000
0.00000
0.03371
8
0.00000
0.00000
-0.00412
9
0.00000
0.00000
-0.03031
10
0.00000
0.00000
-0.01197
11
0.00000
0.00000
0.00118
12
0.00000
0.00000
0.10155
13
0.00000
0.00000
-0.03470
14
0.00000
0.00000
-0.09693
15
0.00000
0.00000
0.01401
16
0.00000
0.00000
-0.00507
17
0.00000
0.00000
0.00642
18
0.00000
0.00000
0.00268
19
0.00000
0.00000
-0.00856
20
0.00000
0.00000
-0.00556
21
0.00000
0.00000
-0.19989
22
0.00000
0.00000
0.05646
23
0.00000
0.00000
0.17715
24
0.00000
0.00000
0.03891
25
0.00000
0.00000
-0.53739
26
0.00000
0.00000
0.16163
27
0.00000
0.00000
0.52094
28
0.00000
0.00000
0.02031
29
0.00000
0.00000
0.05521
30
0.00000
0.00000
-0.01194
31
0.00000
0.00000
-0.05042
32
0.00000
0.00000
0.01948