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)
-0.08300
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.00354
2
0.00000
0.00000
0.00108
3
0.00000
0.00000
-0.01385
4
0.00000
0.00000
0.02317
5
0.00000
0.00000
-0.01103
6
0.00000
0.00000
-0.00129
7
0.00000
0.00000
0.09100
8
0.00000
0.00000
-0.09837
9
0.00000
0.00000
0.02795
10
0.00000
0.00000
-0.02072
11
0.00000
0.00000
0.00123
12
0.00000
0.00000
-0.00216
13
0.00000
0.00000
0.02075
14
0.00000
0.00000
0.02955
15
0.00000
0.00000
-0.01535
16
0.00000
0.00000
-0.03579
17
0.00000
0.00000
0.02673
18
0.00000
0.00000
-0.01617
19
0.00000
0.00000
-0.02658
20
0.00000
0.00000
0.03420
21
0.00000
0.00000
-0.47169
22
0.00000
0.00000
0.51979
23
0.00000
0.00000
-0.14275
24
0.00000
0.00000
0.10680
25
0.00000
0.00000
-0.00120
26
0.00000
0.00000
-0.09371
27
0.00000
0.00000
-0.15736
28
0.00000
0.00000
0.20757
29
0.00000
0.00000
0.14110
30
0.00000
0.00000
0.09653
31
0.00000
0.00000
-0.16390
32
0.00000
0.00000
-0.17003