Charge: 1
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/q+1
Electronic States
Energy
(eV)
-768.43015
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.02846 b
(cm-1)
0.00844 c
(cm-1)
0.00651
Dipole Moments
mu_x(Debye)
0.18438 mu_y
(Debye)
0.13618 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)
-0.20200
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.10626
2
0.00000
0.00000
0.14261
3
0.00000
0.00000
0.02524
4
0.00000
0.00000
0.08332
5
0.00000
0.00000
0.00960
6
0.00000
0.00000
0.07877
7
0.00000
0.00000
-0.07511
8
0.00000
0.00000
-0.03340
9
0.00000
0.00000
-0.06878
10
0.00000
0.00000
-0.02284
11
0.00000
0.00000
-0.00630
12
0.00000
0.00000
0.00287
13
0.00000
0.00000
-0.05504
14
0.00000
0.00000
-0.02109
15
0.00000
0.00000
-0.01327
16
0.00000
0.00000
-0.06913
17
0.00000
0.00000
-0.02615
18
0.00000
0.00000
-0.01689
19
0.00000
0.00000
0.02595
20
0.00000
0.00000
0.02323
21
0.00000
0.00000
-0.20912
22
0.00000
0.00000
-0.14172
23
0.00000
0.00000
-0.18442
24
0.00000
0.00000
-0.11176
25
0.00000
0.00000
-0.06923
26
0.00000
0.00000
-0.11921
27
0.00000
0.00000
-0.10945
28
0.00000
0.00000
-0.17881
29
0.00000
0.00000
0.05807
30
0.00000
0.00000
-0.02534
31
0.00000
0.00000
-0.02807
32
0.00000
0.00000
0.04928