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)
-0.12400
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.00098
2
0.00000
0.00000
0.00020
3
0.00000
0.00000
0.00221
4
0.00000
0.00000
0.00126
5
0.00000
0.00000
0.00440
6
0.00000
0.00000
-0.00082
7
0.00000
0.00000
0.00558
8
0.00000
0.00000
-0.00597
9
0.00000
0.00000
-0.00461
10
0.00000
0.00000
0.00328
11
0.00000
0.00000
-0.00516
12
0.00000
0.00000
-0.00289
13
0.00000
0.00000
-0.01081
14
0.00000
0.00000
0.00063
15
0.00000
0.00000
0.00511
16
0.00000
0.00000
0.00157
17
0.00000
0.00000
0.04980
18
0.00000
0.00000
-0.10876
19
0.00000
0.00000
0.10900
20
0.00000
0.00000
-0.04767
21
0.00000
0.00000
-0.04097
22
0.00000
0.00000
0.03438
23
0.00000
0.00000
0.02167
24
0.00000
0.00000
-0.01542
25
0.00000
0.00000
0.01371
26
0.00000
0.00000
0.05478
27
0.00000
0.00000
-0.00361
28
0.00000
0.00000
-0.00713
29
0.00000
0.00000
-0.53050
30
0.00000
0.00000
0.52060
31
0.00000
0.00000
-0.20874
32
0.00000
0.00000
0.21637