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)
0.49200
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.05073
2
0.00000
0.00000
0.02776
3
0.00000
0.00000
-0.00834
4
0.00000
0.00000
0.02129
5
0.00000
0.00000
0.01283
6
0.00000
0.00000
0.01387
7
0.00000
0.00000
0.03409
8
0.00000
0.00000
0.02503
9
0.00000
0.00000
0.01562
10
0.00000
0.00000
0.02706
11
0.00000
0.00000
-0.00762
12
0.00000
0.00000
-0.05873
13
0.00000
0.00000
-0.00728
14
0.00000
0.00000
-0.04492
15
0.00000
0.00000
0.03377
16
0.00000
0.00000
-0.05533
17
0.00000
0.00000
-0.00712
18
0.00000
0.00000
-0.01891
19
0.00000
0.00000
0.00659
20
0.00000
0.00000
-0.00925
21
0.00000
0.00000
-0.17223
22
0.00000
0.00000
-0.29424
23
0.00000
0.00000
-0.15546
24
0.00000
0.00000
-0.21294
25
0.00000
0.00000
0.51836
26
0.00000
0.00000
-0.04761
27
0.00000
0.00000
0.41693
28
0.00000
0.00000
0.37435
29
0.00000
0.00000
0.04450
30
0.00000
0.00000
0.07987
31
0.00000
0.00000
0.07855
32
0.00000
0.00000
-0.03112