Charge: 0
Inchi:1S/C20H12/c1-2-8-16-15(7-1)17-9-3-5-13-11-12-14-6-4-10-18(16)20(14)19(13)17/h1-12H
Electronic States
Energy
(eV)
-768.42261
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.01712 b
(cm-1)
0.01286 c
(cm-1)
0.00734
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.03249
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)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.06058
0.00000
0.00000
2
0.06058
0.00000
0.00000
3
-0.08598
0.00000
0.00000
4
0.08598
0.00000
0.00000
5
-0.08766
0.00000
0.00000
6
0.08766
0.00000
0.00000
7
-0.02673
0.00000
0.00000
8
0.02673
0.00000
0.00000
9
-0.06837
0.00000
0.00000
10
0.06837
0.00000
0.00000
11
-0.05121
0.00000
0.00000
12
0.05121
0.00000
0.00000
13
0.02777
0.00000
0.00000
14
-0.02777
0.00000
0.00000
15
0.08123
0.00000
0.00000
16
-0.08123
0.00000
0.00000
17
0.01658
0.00000
0.00000
18
-0.01658
0.00000
0.00000
19
0.03010
0.00000
0.00000
20
-0.03010
0.00000
0.00000
21
0.20547
0.00000
0.00000
22
-0.20547
0.00000
0.00000
23
-0.06031
0.00000
0.00000
24
0.06031
0.00000
0.00000
25
0.10512
0.00000
0.00000
26
-0.10512
0.00000
0.00000
27
-0.11382
0.00000
0.00000
28
0.11382
0.00000
0.00000
29
0.03665
0.00000
0.00000
30
-0.03665
0.00000
0.00000
31
0.06713
0.00000
0.00000
32
-0.06713
0.00000
0.00000