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)
0.23600
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.00803
2
0.00000
0.00000
-0.00136
3
0.00000
0.00000
0.11492
4
0.00000
0.00000
-0.10694
5
0.00000
0.00000
-0.10122
6
0.00000
0.00000
0.11305
7
0.00000
0.00000
-0.06059
8
0.00000
0.00000
0.06291
9
0.00000
0.00000
0.06204
10
0.00000
0.00000
-0.05831
11
0.00000
0.00000
0.01542
12
0.00000
0.00000
0.00222
13
0.00000
0.00000
0.00184
14
0.00000
0.00000
-0.00887
15
0.00000
0.00000
-0.02716
16
0.00000
0.00000
0.00654
17
0.00000
0.00000
-0.03636
18
0.00000
0.00000
0.01631
19
0.00000
0.00000
-0.02550
20
0.00000
0.00000
0.01437
21
0.00000
0.00000
-0.19711
22
0.00000
0.00000
0.17364
23
0.00000
0.00000
0.14935
24
0.00000
0.00000
-0.19040
25
0.00000
0.00000
0.09355
26
0.00000
0.00000
0.16013
27
0.00000
0.00000
-0.13851
28
0.00000
0.00000
-0.00679
29
0.00000
0.00000
0.01445
30
0.00000
0.00000
0.12406
31
0.00000
0.00000
0.02930
32
0.00000
0.00000
0.08268