Charge: 1
Inchi:1S/C18H12/c1-3-7-15-13(5-1)9-11-18-16-8-4-2-6-14(16)10-12-17(15)18/h1-12H/q+1
Electronic States
Energy
(eV)
-691.62195
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2h
Symmetry Elements
E
C2(z)
sigmah(xy)
i
Rotational Constants
(cm-1)
0.04269 b
(cm-1)
0.00858 c
(cm-1)
0.00715
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-0.60600
Diff mu Y
(Debye)
-0.45800
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.01170
-0.02248
0.00000
2
-0.01180
-0.02252
0.00000
3
-0.00156
0.04363
0.00000
4
-0.01223
-0.04896
0.00000
5
-0.00927
-0.00552
0.00000
6
0.05023
0.03972
0.00000
7
-0.03753
-0.03079
0.00000
8
-0.01162
-0.02039
0.00000
9
0.09305
0.01003
0.00000
10
-0.02221
0.02887
0.00000
11
-0.02225
0.02899
0.00000
12
0.09331
0.01005
0.00000
13
-0.01165
-0.02049
0.00000
14
-0.03764
-0.03080
0.00000
15
0.05041
0.03978
0.00000
16
-0.00932
-0.00552
0.00000
17
-0.01229
-0.04908
0.00000
18
-0.00153
0.04363
0.00000
19
0.06252
0.13703
0.00000
20
-0.10077
-0.16590
0.00000
21
-0.33279
-0.05659
0.00000
22
-0.14109
0.13509
0.00000
23
-0.00620
0.08322
0.00000
24
0.07622
-0.06225
0.00000
25
0.07648
-0.06267
0.00000
26
-0.00631
0.08324
0.00000
27
-0.14153
0.13548
0.00000
28
-0.33385
-0.05678
0.00000
29
-0.10111
-0.16653
0.00000
30
0.06270
0.13756
0.00000