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)
-0.06300
Diff mu Y
(Debye)
0.36000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00006
0.00047
0.00000
2
0.00002
0.00030
0.00000
3
0.00099
-0.00068
0.00000
4
-0.00044
-0.00049
0.00000
5
-0.00024
-0.00004
0.00000
6
0.00058
-0.00040
0.00000
7
-0.01212
-0.01030
0.00000
8
-0.02559
0.00974
0.00000
9
-0.00004
0.00035
0.00000
10
0.00652
0.00668
0.00000
11
-0.00031
-0.00086
0.00000
12
-0.05010
0.01460
0.00000
13
-0.00288
0.00071
0.00000
14
0.02310
0.01820
0.00000
15
-0.00032
-0.00007
0.00000
16
-0.00755
0.03814
0.00000
17
0.02423
-0.00752
0.00000
18
0.00289
0.00354
0.00000
19
0.00132
-0.00835
0.00000
20
0.00615
-0.00173
0.00000
21
0.13065
0.11139
0.00000
22
0.30129
-0.09786
0.00000
23
0.01016
-0.00397
0.00000
24
-0.07962
-0.07103
0.00000
25
0.57278
-0.19008
0.00000
26
0.04301
-0.01390
0.00000
27
-0.24822
-0.21938
0.00000
28
0.08341
-0.42239
0.00000
29
-0.02213
0.09555
0.00000
30
-0.03379
-0.03222
0.00000
31
-0.28779
0.08243
0.00000
32
-0.06807
0.01975
0.00000