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)
-768.18063
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)
0.34700
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.07220
2
0.00000
0.00000
-0.03973
3
0.00000
0.00000
-0.04142
4
0.00000
0.00000
0.00403
5
0.00000
0.00000
-0.02838
6
0.00000
0.00000
-0.00673
7
0.00000
0.00000
-0.01568
8
0.00000
0.00000
-0.03940
9
0.00000
0.00000
-0.01559
10
0.00000
0.00000
-0.03200
11
0.00000
0.00000
0.04154
12
0.00000
0.00000
0.04875
13
0.00000
0.00000
0.01845
14
0.00000
0.00000
0.05016
15
0.00000
0.00000
-0.00002
16
0.00000
0.00000
0.03444
17
0.00000
0.00000
-0.01496
18
0.00000
0.00000
-0.02382
19
0.00000
0.00000
-0.02613
20
0.00000
0.00000
-0.03130
21
0.00000
0.00000
0.24403
22
0.00000
0.00000
0.20395
23
0.00000
0.00000
0.20615
24
0.00000
0.00000
0.19657
25
0.00000
0.00000
-0.32012
26
0.00000
0.00000
-0.05499
27
0.00000
0.00000
-0.31551
28
0.00000
0.00000
-0.40271
29
0.00000
0.00000
0.25760
30
0.00000
0.00000
0.21165
31
0.00000
0.00000
0.09780
32
0.00000
0.00000
0.21840