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)
0.37400
Diff mu Y
(Debye)
0.67100
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.02494
0.02991
0.00000
2
-0.03442
-0.03147
0.00000
3
-0.04533
0.01108
0.00000
4
0.03446
-0.03186
0.00000
5
-0.04739
-0.04524
0.00000
6
0.05778
0.05695
0.00000
7
0.01125
-0.04538
0.00000
8
-0.01299
0.10725
0.00000
9
0.02175
0.04481
0.00000
10
-0.04824
-0.06497
0.00000
11
-0.02606
0.06855
0.00000
12
0.05653
-0.11248
0.00000
13
-0.02717
-0.01361
0.00000
14
0.07122
0.03145
0.00000
15
-0.01489
0.04086
0.00000
16
-0.00774
-0.03974
0.00000
17
0.01438
0.01276
0.00000
18
0.00077
-0.02353
0.00000
19
0.00448
-0.05391
0.00000
20
-0.00428
0.07946
0.00000
21
-0.01488
-0.09203
0.00000
22
0.00434
0.12000
0.00000
23
-0.08554
-0.10650
0.00000
24
-0.02940
-0.01272
0.00000
25
-0.10474
-0.01058
0.00000
26
-0.15215
0.10756
0.00000
27
0.05482
-0.03582
0.00000
28
0.01828
0.03625
0.00000
29
-0.00068
0.00805
0.00000
30
-0.03353
0.01572
0.00000