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)
-0.14200
Diff mu Y
(Debye)
-0.52100
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.04086
0.01121
0.00000
2
0.01711
0.02219
0.00000
3
-0.01101
-0.03304
0.00000
4
-0.02846
-0.00098
0.00000
5
-0.04422
-0.01266
0.00000
6
0.01773
-0.07199
0.00000
7
-0.03143
0.07195
0.00000
8
0.01260
-0.06487
0.00000
9
0.02472
-0.07103
0.00000
10
-0.05778
0.10425
0.00000
11
0.00888
-0.02322
0.00000
12
0.04686
0.04489
0.00000
13
0.03271
0.04793
0.00000
14
0.02329
0.02523
0.00000
15
-0.03035
-0.00393
0.00000
16
-0.07173
-0.02848
0.00000
17
0.00400
0.06779
0.00000
18
0.01354
-0.05805
0.00000
19
0.03465
0.04006
0.00000
20
-0.02510
-0.04364
0.00000
21
0.09988
-0.07556
0.00000
22
0.05445
0.05462
0.00000
23
0.06804
0.03719
0.00000
24
0.15718
-0.13397
0.00000
25
0.00719
-0.07609
0.00000
26
-0.01649
-0.10027
0.00000
27
0.05811
-0.00939
0.00000
28
0.08646
0.00231
0.00000
29
-0.10205
0.01134
0.00000
30
-0.09095
0.04833
0.00000
31
-0.04275
-0.08754
0.00000
32
-0.00353
0.04811
0.00000