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)
-0.17100
Diff mu Y
(Debye)
0.21400
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.05762
0.02010
0.00000
2
0.04683
-0.00223
0.00000
3
0.04567
0.07472
0.00000
4
0.05425
0.10464
0.00000
5
0.00109
-0.06440
0.00000
6
-0.04092
-0.11539
0.00000
7
0.03789
-0.05189
0.00000
8
-0.03236
0.01173
0.00000
9
0.01659
-0.01532
0.00000
10
-0.03109
-0.00321
0.00000
11
-0.04430
-0.02698
0.00000
12
-0.00298
-0.01634
0.00000
13
-0.00389
0.02502
0.00000
14
0.00985
0.03210
0.00000
15
-0.00043
0.00953
0.00000
16
-0.01750
-0.00763
0.00000
17
0.01556
-0.00984
0.00000
18
-0.00665
0.02787
0.00000
19
-0.08713
-0.07562
0.00000
20
0.05989
0.00356
0.00000
21
0.05763
0.11295
0.00000
22
0.03470
0.24767
0.00000
23
-0.14465
-0.32642
0.00000
24
-0.00729
0.02793
0.00000
25
0.09989
0.05592
0.00000
26
0.10381
-0.13185
0.00000
27
-0.02283
0.03702
0.00000
28
0.01059
0.08483
0.00000
29
0.04555
-0.00290
0.00000
30
-0.03117
0.05642
0.00000