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)
-0.09700
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00063
2
0.00000
0.00000
-0.00400
3
0.00000
0.00000
0.00379
4
0.00000
0.00000
-0.01228
5
0.00000
0.00000
0.01249
6
0.00000
0.00000
-0.01869
7
0.00000
0.00000
-0.02356
8
0.00000
0.00000
0.03061
9
0.00000
0.00000
-0.06595
10
0.00000
0.00000
0.07127
11
0.00000
0.00000
-0.00232
12
0.00000
0.00000
0.05338
13
0.00000
0.00000
-0.01464
14
0.00000
0.00000
0.05587
15
0.00000
0.00000
0.00636
16
0.00000
0.00000
-0.08054
17
0.00000
0.00000
-0.00482
18
0.00000
0.00000
0.00485
19
0.00000
0.00000
0.00095
20
0.00000
0.00000
-0.00488
21
0.00000
0.00000
0.12515
22
0.00000
0.00000
-0.15781
23
0.00000
0.00000
0.37068
24
0.00000
0.00000
-0.39211
25
0.00000
0.00000
-0.28657
26
0.00000
0.00000
0.06526
27
0.00000
0.00000
-0.29178
28
0.00000
0.00000
0.44260
29
0.00000
0.00000
-0.00144
30
0.00000
0.00000
-0.03067
31
0.00000
0.00000
0.03601
32
0.00000
0.00000
0.01968