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)
0.06100
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.00216
2
0.00000
0.00000
0.04244
3
0.00000
0.00000
-0.00282
4
0.00000
0.00000
-0.03421
5
0.00000
0.00000
-0.00277
6
0.00000
0.00000
-0.01779
7
0.00000
0.00000
0.00857
8
0.00000
0.00000
0.09966
9
0.00000
0.00000
0.01323
10
0.00000
0.00000
0.01894
11
0.00000
0.00000
0.03854
12
0.00000
0.00000
-0.11030
13
0.00000
0.00000
-0.01803
14
0.00000
0.00000
-0.00078
15
0.00000
0.00000
-0.03424
16
0.00000
0.00000
0.04425
17
0.00000
0.00000
-0.00300
18
0.00000
0.00000
-0.03468
19
0.00000
0.00000
0.02365
20
0.00000
0.00000
-0.19373
21
0.00000
0.00000
-0.05402
22
0.00000
0.00000
-0.09155
23
0.00000
0.00000
-0.44292
24
0.00000
0.00000
0.09056
25
0.00000
0.00000
0.00123
26
0.00000
0.00000
0.50963
27
0.00000
0.00000
0.14533
28
0.00000
0.00000
-0.21663
29
0.00000
0.00000
0.00439
30
0.00000
0.00000
0.16636