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)
-692.03603
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03932 b
(cm-1)
0.00852 c
(cm-1)
0.00700
Dipole Moments
mu_x(Debye)
0.12919 mu_y
(Debye)
-0.56125 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)
0.17200
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00195
2
0.00000
0.00000
0.00872
3
0.00000
0.00000
0.00367
4
0.00000
0.00000
-0.01333
5
0.00000
0.00000
0.00408
6
0.00000
0.00000
0.00121
7
0.00000
0.00000
-0.01253
8
0.00000
0.00000
0.04257
9
0.00000
0.00000
-0.01933
10
0.00000
0.00000
-0.01871
11
0.00000
0.00000
-0.01073
12
0.00000
0.00000
-0.02971
13
0.00000
0.00000
0.01420
14
0.00000
0.00000
0.01488
15
0.00000
0.00000
0.07579
16
0.00000
0.00000
-0.07163
17
0.00000
0.00000
-0.05213
18
0.00000
0.00000
0.07677
19
0.00000
0.00000
-0.03633
20
0.00000
0.00000
-0.03813
21
0.00000
0.00000
0.10092
22
0.00000
0.00000
0.09891
23
0.00000
0.00000
-0.22141
24
0.00000
0.00000
-0.07838
25
0.00000
0.00000
-0.08471
26
0.00000
0.00000
0.16260
27
0.00000
0.00000
-0.38535
28
0.00000
0.00000
0.40096
29
0.00000
0.00000
0.32172
30
0.00000
0.00000
-0.42837