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)
-0.11500
Diff mu Y
(Debye)
1.00800
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.03259
0.00834
0.00000
2
-0.00489
0.00104
0.00000
3
-0.00117
0.00016
0.00000
4
0.00000
0.00027
0.00000
5
-0.00064
-0.00047
0.00000
6
-0.00028
0.00002
0.00000
7
0.00035
-0.00133
0.00000
8
-0.00903
0.00243
0.00000
9
-0.01176
0.00400
0.00000
10
-0.00149
0.00047
0.00000
11
0.00014
-0.00098
0.00000
12
-0.00863
-0.00788
0.00000
13
-0.00626
-0.00553
0.00000
14
0.00090
-0.00297
0.00000
15
-0.04861
-0.04415
0.00000
16
-0.02075
0.00888
0.00000
17
-0.00092
0.00722
0.00000
18
-0.00611
-0.00428
0.00000
19
0.40091
-0.10915
0.00000
20
0.06223
-0.01723
0.00000
21
0.14603
-0.04104
0.00000
22
0.02032
-0.00670
0.00000
23
0.11125
-0.03505
0.00000
24
0.07009
0.06765
0.00000
25
-0.00847
0.03194
0.00000
26
0.10930
0.10055
0.00000
27
0.57997
0.50734
0.00000
28
0.22683
-0.07485
0.00000
29
0.01064
-0.07786
0.00000
30
0.07762
0.06846
0.00000