Charge: -1
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-1
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)
0.12200
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.12312
2
0.00000
0.00000
-0.04782
3
0.00000
0.00000
0.07178
4
0.00000
0.00000
0.04144
5
0.00000
0.00000
-0.01745
6
0.00000
0.00000
-0.07569
7
0.00000
0.00000
-0.01302
8
0.00000
0.00000
0.05468
9
0.00000
0.00000
-0.08162
10
0.00000
0.00000
-0.02573
11
0.00000
0.00000
-0.05377
12
0.00000
0.00000
-0.01279
13
0.00000
0.00000
-0.01709
14
0.00000
0.00000
0.09045
15
0.00000
0.00000
-0.07902
16
0.00000
0.00000
0.01946
17
0.00000
0.00000
0.06571
18
0.00000
0.00000
-0.05698
19
0.00000
0.00000
0.24392
20
0.00000
0.00000
-0.09514
21
0.00000
0.00000
-0.12188
22
0.00000
0.00000
-0.04222
23
0.00000
0.00000
0.08885
24
0.00000
0.00000
-0.01933
25
0.00000
0.00000
0.21054
26
0.00000
0.00000
-0.03177
27
0.00000
0.00000
-0.15463
28
0.00000
0.00000
0.05131
29
0.00000
0.00000
0.15042
30
0.00000
0.00000
-0.10915