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)
0.17100
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.05393
2
0.00000
0.00000
-0.05614
3
0.00000
0.00000
-0.03522
4
0.00000
0.00000
-0.08965
5
0.00000
0.00000
0.10689
6
0.00000
0.00000
0.04585
7
0.00000
0.00000
0.01804
8
0.00000
0.00000
-0.00518
9
0.00000
0.00000
0.00441
10
0.00000
0.00000
-0.03131
11
0.00000
0.00000
-0.03850
12
0.00000
0.00000
0.06879
13
0.00000
0.00000
-0.06706
14
0.00000
0.00000
0.04205
15
0.00000
0.00000
0.01696
16
0.00000
0.00000
-0.07291
17
0.00000
0.00000
-0.01358
18
0.00000
0.00000
0.04417
19
0.00000
0.00000
-0.06727
20
0.00000
0.00000
0.06129
21
0.00000
0.00000
0.09458
22
0.00000
0.00000
0.06267
23
0.00000
0.00000
-0.08301
24
0.00000
0.00000
-0.13257
25
0.00000
0.00000
0.30227
26
0.00000
0.00000
-0.25995
27
0.00000
0.00000
0.12740
28
0.00000
0.00000
-0.10214
29
0.00000
0.00000
-0.12600
30
0.00000
0.00000
0.14343
31
0.00000
0.00000
-0.03511
32
0.00000
0.00000
0.18020