Charge: 2
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+2
Electronic States
Energy
(eV)
-768.18063
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.02857 b
(cm-1)
0.00852 c
(cm-1)
0.00656
Dipole Moments
mu_x(Debye)
-0.12448 mu_y
(Debye)
-0.13148 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)
-0.03900
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00108
2
0.00000
0.00000
-0.00411
3
0.00000
0.00000
0.00290
4
0.00000
0.00000
-0.01580
5
0.00000
0.00000
0.00662
6
0.00000
0.00000
-0.01818
7
0.00000
0.00000
-0.01927
8
0.00000
0.00000
0.02792
9
0.00000
0.00000
-0.03090
10
0.00000
0.00000
0.03888
11
0.00000
0.00000
-0.00102
12
0.00000
0.00000
0.06841
13
0.00000
0.00000
-0.00692
14
0.00000
0.00000
0.07437
15
0.00000
0.00000
0.00309
16
0.00000
0.00000
-0.11040
17
0.00000
0.00000
-0.00118
18
0.00000
0.00000
-0.00042
19
0.00000
0.00000
0.00352
20
0.00000
0.00000
-0.00390
21
0.00000
0.00000
0.09101
22
0.00000
0.00000
-0.13494
23
0.00000
0.00000
0.15370
24
0.00000
0.00000
-0.19285
25
0.00000
0.00000
-0.33826
26
0.00000
0.00000
0.03008
27
0.00000
0.00000
-0.37206
28
0.00000
0.00000
0.57609
29
0.00000
0.00000
-0.01696
30
0.00000
0.00000
0.00018
31
0.00000
0.00000
0.01150
32
0.00000
0.00000
0.01779