Charge: 0
Inchi:1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H
Electronic States
Energy
(eV)
-768.43015
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.02846 b
(cm-1)
0.00844 c
(cm-1)
0.00651
Dipole Moments
mu_x(Debye)
0.18438 mu_y
(Debye)
0.13618 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-1.82100
Diff mu Y
(Debye)
-0.35600
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.06797
-0.05846
0.00000
2
-0.08928
0.02210
0.00000
3
0.06965
0.01643
0.00000
4
0.05307
-0.04070
0.00000
5
0.08722
0.00098
0.00000
6
0.10349
0.07905
0.00000
7
-0.02283
0.04122
0.00000
8
-0.01219
-0.04744
0.00000
9
-0.01978
-0.03840
0.00000
10
-0.04746
0.01661
0.00000
11
-0.02814
0.00350
0.00000
12
0.01270
0.03785
0.00000
13
-0.00745
0.03107
0.00000
14
0.02365
-0.06566
0.00000
15
0.00356
-0.04111
0.00000
16
-0.04300
0.00997
0.00000
17
0.01236
0.02956
0.00000
18
0.01860
-0.02884
0.00000
19
-0.03167
0.00297
0.00000
20
0.00800
0.01475
0.00000
21
-0.06178
0.08706
0.00000
22
0.01446
0.02635
0.00000
23
-0.04875
-0.12143
0.00000
24
-0.14835
0.12924
0.00000
25
0.01336
0.04102
0.00000
26
0.00602
0.06203
0.00000
27
0.03035
-0.06980
0.00000
28
-0.08599
0.00168
0.00000
29
0.04313
0.02166
0.00000
30
-0.02810
0.02216
0.00000
31
-0.01695
-0.06974
0.00000
32
0.01451
0.04341
0.00000