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)
-691.62999
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03982 b
(cm-1)
0.00842 c
(cm-1)
0.00695
Dipole Moments
mu_x(Debye)
-0.27351 mu_y
(Debye)
0.67795 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)
0.40800
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.01368
2
0.00000
0.00000
0.00010
3
0.00000
0.00000
-0.11252
4
0.00000
0.00000
0.09157
5
0.00000
0.00000
-0.00952
6
0.00000
0.00000
0.01016
7
0.00000
0.00000
0.14634
8
0.00000
0.00000
-0.03136
9
0.00000
0.00000
0.00903
10
0.00000
0.00000
-0.00248
11
0.00000
0.00000
-0.09762
12
0.00000
0.00000
0.03663
13
0.00000
0.00000
0.00146
14
0.00000
0.00000
0.00435
15
0.00000
0.00000
-0.01864
16
0.00000
0.00000
0.00554
17
0.00000
0.00000
-0.04735
18
0.00000
0.00000
-0.01331
19
0.00000
0.00000
0.21990
20
0.00000
0.00000
-0.12180
21
0.00000
0.00000
-0.04217
22
0.00000
0.00000
-0.00144
23
0.00000
0.00000
-0.14921
24
0.00000
0.00000
-0.03831
25
0.00000
0.00000
-0.02003
26
0.00000
0.00000
0.07429
27
0.00000
0.00000
-0.14925
28
0.00000
0.00000
0.16599
29
0.00000
0.00000
0.21106
30
0.00000
0.00000
0.34259