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)
0.10800
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.09094
2
0.00000
0.00000
-0.00364
3
0.00000
0.00000
0.10534
4
0.00000
0.00000
-0.06265
5
0.00000
0.00000
0.05960
6
0.00000
0.00000
-0.06177
7
0.00000
0.00000
0.06000
8
0.00000
0.00000
-0.08303
9
0.00000
0.00000
0.05662
10
0.00000
0.00000
-0.03717
11
0.00000
0.00000
0.00029
12
0.00000
0.00000
0.00594
13
0.00000
0.00000
-0.06463
14
0.00000
0.00000
-0.03222
15
0.00000
0.00000
-0.06242
16
0.00000
0.00000
0.06725
17
0.00000
0.00000
-0.07516
18
0.00000
0.00000
0.00619
19
0.00000
0.00000
0.07080
20
0.00000
0.00000
-0.04246
21
0.00000
0.00000
0.08322
22
0.00000
0.00000
-0.14731
23
0.00000
0.00000
0.06904
24
0.00000
0.00000
-0.06185
25
0.00000
0.00000
0.05186
26
0.00000
0.00000
-0.13214
27
0.00000
0.00000
-0.01759
28
0.00000
0.00000
0.17017
29
0.00000
0.00000
0.16895
30
0.00000
0.00000
0.02094
31
0.00000
0.00000
-0.13526
32
0.00000
0.00000
-0.04402