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)
-0.21900
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.00310
2
0.00000
0.00000
0.00227
3
0.00000
0.00000
-0.01166
4
0.00000
0.00000
0.02756
5
0.00000
0.00000
-0.02296
6
0.00000
0.00000
-0.00595
7
0.00000
0.00000
0.07252
8
0.00000
0.00000
-0.08460
9
0.00000
0.00000
0.02941
10
0.00000
0.00000
-0.01368
11
0.00000
0.00000
-0.00557
12
0.00000
0.00000
-0.02121
13
0.00000
0.00000
0.05167
14
0.00000
0.00000
0.03615
15
0.00000
0.00000
-0.03173
16
0.00000
0.00000
-0.02406
17
0.00000
0.00000
0.04324
18
0.00000
0.00000
-0.03765
19
0.00000
0.00000
-0.03265
20
0.00000
0.00000
0.06102
21
0.00000
0.00000
-0.34679
22
0.00000
0.00000
0.41684
23
0.00000
0.00000
-0.14078
24
0.00000
0.00000
0.05345
25
0.00000
0.00000
0.10090
26
0.00000
0.00000
-0.24225
27
0.00000
0.00000
-0.18748
28
0.00000
0.00000
0.14378
29
0.00000
0.00000
0.17394
30
0.00000
0.00000
0.19690
31
0.00000
0.00000
-0.21453
32
0.00000
0.00000
-0.29966