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)
-768.43015
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.02846 b
(cm-1)
0.00844 c
(cm-1)
0.00651
Dipole Moments
mu_x(Debye)
0.18438 mu_y
(Debye)
0.13618 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)
-1.01700
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.07565
2
0.00000
0.00000
0.12759
3
0.00000
0.00000
0.00918
4
0.00000
0.00000
-0.13595
5
0.00000
0.00000
0.01916
6
0.00000
0.00000
-0.10393
7
0.00000
0.00000
0.01907
8
0.00000
0.00000
0.06625
9
0.00000
0.00000
0.00689
10
0.00000
0.00000
0.04448
11
0.00000
0.00000
0.01617
12
0.00000
0.00000
0.07285
13
0.00000
0.00000
0.01058
14
0.00000
0.00000
0.03996
15
0.00000
0.00000
-0.01377
16
0.00000
0.00000
-0.01053
17
0.00000
0.00000
-0.01834
18
0.00000
0.00000
0.00612
19
0.00000
0.00000
0.00397
20
0.00000
0.00000
0.01178
21
0.00000
0.00000
-0.26113
22
0.00000
0.00000
-0.16423
23
0.00000
0.00000
-0.18941
24
0.00000
0.00000
-0.06941
25
0.00000
0.00000
-0.16355
26
0.00000
0.00000
-0.06660
27
0.00000
0.00000
-0.01481
28
0.00000
0.00000
-0.15750
29
0.00000
0.00000
-0.05175
30
0.00000
0.00000
-0.01120
31
0.00000
0.00000
0.04932
32
0.00000
0.00000
-0.04110