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)
-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)
0.87700
Diff mu Y
(Debye)
-0.03300
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.01279
-0.05324
0.00000
2
0.00433
0.03172
0.00000
3
0.01663
0.07704
0.00000
4
-0.00739
-0.04175
0.00000
5
-0.05139
-0.02426
0.00000
6
0.02191
0.04779
0.00000
7
-0.00867
-0.04865
0.00000
8
0.00229
-0.04789
0.00000
9
0.05242
0.00895
0.00000
10
0.01260
-0.06573
0.00000
11
-0.00789
0.03276
0.00000
12
-0.00149
0.04003
0.00000
13
-0.04243
0.07228
0.00000
14
-0.05770
-0.02469
0.00000
15
-0.00563
0.01118
0.00000
16
-0.00643
0.01519
0.00000
17
0.04123
0.00708
0.00000
18
-0.00122
-0.03126
0.00000
19
0.03035
0.13629
0.00000
20
-0.03735
-0.10037
0.00000
21
0.02761
-0.09778
0.00000
22
0.09950
0.21425
0.00000
23
0.04163
0.06241
0.00000
24
0.26546
-0.24440
0.00000
25
0.36264
0.07788
0.00000
26
0.02629
0.01798
0.00000
27
0.08520
-0.09385
0.00000
28
-0.03771
-0.07290
0.00000
29
-0.16466
-0.03678
0.00000
30
-0.08427
0.05921
0.00000