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)
-0.81300
Diff mu Y
(Debye)
0.04000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00397
-0.00503
0.00000
2
-0.00120
-0.00366
0.00000
3
0.02403
-0.02185
0.00000
4
-0.04099
-0.01937
0.00000
5
-0.01645
0.00540
0.00000
6
0.01485
0.01262
0.00000
7
0.04118
0.01391
0.00000
8
0.03874
-0.05174
0.00000
9
0.00610
-0.01461
0.00000
10
0.00747
0.00599
0.00000
11
-0.02837
0.03068
0.00000
12
-0.01464
0.04486
0.00000
13
-0.01214
0.01353
0.00000
14
0.00366
-0.00560
0.00000
15
-0.01501
-0.06299
0.00000
16
-0.01175
0.02482
0.00000
17
0.05123
-0.00424
0.00000
18
-0.05996
0.00999
0.00000
19
0.00694
0.00091
0.00000
20
0.02756
0.10182
0.00000
21
-0.02353
-0.11559
0.00000
22
0.01158
0.01433
0.00000
23
-0.04196
-0.31899
0.00000
24
-0.12122
0.12747
0.00000
25
0.03494
0.00136
0.00000
26
-0.22967
0.28635
0.00000
27
0.12534
-0.22545
0.00000
28
0.05386
0.22792
0.00000
29
0.45210
0.07581
0.00000
30
-0.18547
0.14909
0.00000