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)
-768.41876
Description
S1
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.02837 b
(cm-1)
0.00856 c
(cm-1)
0.00657
Dipole Moments
mu_x(Debye)
-0.01429 mu_y
(Debye)
-0.01154 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)
-0.34600
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.10918
2
0.00000
0.00000
0.14294
3
0.00000
0.00000
0.02642
4
0.00000
0.00000
0.08203
5
0.00000
0.00000
0.01598
6
0.00000
0.00000
0.07742
7
0.00000
0.00000
-0.08116
8
0.00000
0.00000
-0.04149
9
0.00000
0.00000
-0.07571
10
0.00000
0.00000
-0.03222
11
0.00000
0.00000
-0.00494
12
0.00000
0.00000
-0.00193
13
0.00000
0.00000
-0.04358
14
0.00000
0.00000
-0.01698
15
0.00000
0.00000
-0.00862
16
0.00000
0.00000
-0.05917
17
0.00000
0.00000
-0.02434
18
0.00000
0.00000
-0.00925
19
0.00000
0.00000
0.02324
20
0.00000
0.00000
0.01319
21
0.00000
0.00000
-0.21989
22
0.00000
0.00000
-0.14628
23
0.00000
0.00000
-0.19399
24
0.00000
0.00000
-0.11957
25
0.00000
0.00000
-0.06722
26
0.00000
0.00000
-0.11867
27
0.00000
0.00000
-0.09721
28
0.00000
0.00000
-0.15829
29
0.00000
0.00000
0.05074
30
0.00000
0.00000
-0.01298
31
0.00000
0.00000
-0.02840
32
0.00000
0.00000
0.02785