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)
-0.14800
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00638
2
0.00000
0.00000
-0.04065
3
0.00000
0.00000
-0.07938
4
0.00000
0.00000
-0.09480
5
0.00000
0.00000
0.11661
6
0.00000
0.00000
0.09586
7
0.00000
0.00000
0.01804
8
0.00000
0.00000
-0.01105
9
0.00000
0.00000
0.01199
10
0.00000
0.00000
-0.03682
11
0.00000
0.00000
0.00692
12
0.00000
0.00000
0.07276
13
0.00000
0.00000
-0.06310
14
0.00000
0.00000
0.02538
15
0.00000
0.00000
0.04570
16
0.00000
0.00000
-0.06291
17
0.00000
0.00000
-0.00779
18
0.00000
0.00000
0.02702
19
0.00000
0.00000
-0.02845
20
0.00000
0.00000
0.02331
21
0.00000
0.00000
0.18652
22
0.00000
0.00000
0.11513
23
0.00000
0.00000
-0.11301
24
0.00000
0.00000
-0.21198
25
0.00000
0.00000
0.25249
26
0.00000
0.00000
-0.27647
27
0.00000
0.00000
0.01515
28
0.00000
0.00000
-0.12448
29
0.00000
0.00000
-0.09720
30
0.00000
0.00000
0.03089
31
0.00000
0.00000
-0.08481
32
0.00000
0.00000
0.00988