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)
0.27000
Diff mu Y
(Debye)
-1.38000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00017
0.00037
0.00000
2
-0.00017
0.00032
0.00000
3
0.00017
-0.00018
0.00000
4
-0.00069
-0.00079
0.00000
5
-0.00016
-0.00057
0.00000
6
0.00133
-0.00120
0.00000
7
-0.00325
-0.00181
0.00000
8
0.00761
-0.00249
0.00000
9
0.01675
-0.00474
0.00000
10
-0.01558
-0.01359
0.00000
11
-0.00005
-0.00004
0.00000
12
-0.02527
0.00929
0.00000
13
-0.00214
0.00071
0.00000
14
0.02616
0.02467
0.00000
15
0.00003
0.00018
0.00000
16
0.01154
-0.05739
0.00000
17
0.00078
-0.00003
0.00000
18
-0.00064
-0.00082
0.00000
19
0.00040
-0.00228
0.00000
20
-0.00037
0.00020
0.00000
21
0.03491
0.02882
0.00000
22
-0.08776
0.02873
0.00000
23
-0.20279
0.06639
0.00000
24
0.18181
0.16236
0.00000
25
0.31817
-0.10760
0.00000
26
0.02554
-0.00753
0.00000
27
-0.32810
-0.29306
0.00000
28
-0.13856
0.68915
0.00000
29
-0.00568
0.02425
0.00000
30
0.00720
0.00605
0.00000
31
-0.00973
0.00225
0.00000
32
0.00723
-0.00232
0.00000