Charge: 2
Inchi:1S/C18H12/c1-2-7-15-12-18-16(11-14(15)6-1)10-9-13-5-3-4-8-17(13)18/h1-12H/q+2
Electronic States
Energy
(eV)
-692.28642
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03906 b
(cm-1)
0.00844 c
(cm-1)
0.00694
Dipole Moments
mu_x(Debye)
-0.13629 mu_y
(Debye)
0.70909 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.77600
Diff mu Y
(Debye)
0.20200
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.03514
0.00911
0.00000
2
0.01572
-0.00524
0.00000
3
0.00019
0.00092
0.00000
4
0.00051
0.00023
0.00000
5
-0.00102
-0.00249
0.00000
6
0.00060
0.00138
0.00000
7
-0.00086
0.00022
0.00000
8
-0.00502
0.00167
0.00000
9
0.02954
-0.00878
0.00000
10
0.04488
-0.01180
0.00000
11
0.00030
-0.00083
0.00000
12
-0.01278
-0.01221
0.00000
13
0.01950
0.02110
0.00000
14
0.00415
-0.02330
0.00000
15
0.01059
0.00936
0.00000
16
0.00006
-0.00063
0.00000
17
-0.00248
0.00981
0.00000
18
0.00009
0.00034
0.00000
19
0.41452
-0.10891
0.00000
20
-0.19207
0.05199
0.00000
21
-0.33825
0.09942
0.00000
22
-0.51934
0.15006
0.00000
23
0.05535
-0.01862
0.00000
24
-0.23918
-0.23323
0.00000
25
-0.06238
0.26335
0.00000
26
0.15540
0.14336
0.00000
27
-0.12070
-0.10493
0.00000
28
-0.00017
0.00114
0.00000
29
0.02414
-0.11430
0.00000
30
0.00298
0.00323
0.00000