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)
0.22000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.00542
2
0.00000
0.00000
-0.04001
3
0.00000
0.00000
0.02338
4
0.00000
0.00000
0.04812
5
0.00000
0.00000
-0.02533
6
0.00000
0.00000
-0.04526
7
0.00000
0.00000
-0.08455
8
0.00000
0.00000
0.06098
9
0.00000
0.00000
0.01156
10
0.00000
0.00000
0.00165
11
0.00000
0.00000
0.12696
12
0.00000
0.00000
-0.01653
13
0.00000
0.00000
-0.02815
14
0.00000
0.00000
0.03344
15
0.00000
0.00000
0.10015
16
0.00000
0.00000
-0.01748
17
0.00000
0.00000
-0.07934
18
0.00000
0.00000
0.02764
19
0.00000
0.00000
0.04311
20
0.00000
0.00000
-0.07727
21
0.00000
0.00000
-0.16993
22
0.00000
0.00000
0.07229
23
0.00000
0.00000
0.07649
24
0.00000
0.00000
0.07333
25
0.00000
0.00000
-0.05325
26
0.00000
0.00000
-0.15177
27
0.00000
0.00000
0.10563
28
0.00000
0.00000
-0.02967
29
0.00000
0.00000
0.01012
30
0.00000
0.00000
-0.03149
31
0.00000
0.00000
-0.30258
32
0.00000
0.00000
-0.28553