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)
0.00400
Diff mu Y
(Debye)
0.99000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.01524
0.02223
0.00000
2
-0.00276
-0.02307
0.00000
3
-0.02344
-0.02768
0.00000
4
0.01249
0.04792
0.00000
5
-0.00135
0.00180
0.00000
6
0.00288
-0.00061
0.00000
7
0.04959
-0.02134
0.00000
8
-0.00670
-0.07303
0.00000
9
0.00140
-0.01855
0.00000
10
0.00557
0.01339
0.00000
11
-0.05067
0.03660
0.00000
12
-0.00384
0.04176
0.00000
13
-0.00869
0.01805
0.00000
14
-0.00272
-0.01011
0.00000
15
-0.05173
0.08443
0.00000
16
0.02579
-0.08060
0.00000
17
-0.11474
0.03665
0.00000
18
0.12133
-0.08038
0.00000
19
0.00055
-0.03523
0.00000
20
0.01405
0.03056
0.00000
21
0.01058
0.01384
0.00000
22
-0.00426
-0.02263
0.00000
23
0.04938
0.09273
0.00000
24
0.02616
-0.01678
0.00000
25
0.01668
-0.00613
0.00000
26
0.03029
0.01203
0.00000
27
0.09365
-0.07806
0.00000
28
0.09975
0.11996
0.00000
29
0.14268
0.10143
0.00000
30
-0.09436
0.17578
0.00000