Charge: 0
Inchi:1S/C28H14/c1-2-4-20-19(3-1)21-13-11-17-9-7-15-5-6-16-8-10-18-12-14-22(20)28-26(18)24(16)23(15)25(17)27(21)28/h1-14H
Electronic States
Energy
(eV)
-1073.90487
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.01067 b
(cm-1)
0.00577 c
(cm-1)
0.00374
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.09400
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.06000
Eigenvectors
#
X
Y
Z
1
0.00000
0.04306
0.01693
2
0.00000
-0.04306
0.01693
3
0.00000
-0.06963
-0.01595
4
0.00000
0.07075
-0.01211
5
0.00000
-0.07075
-0.01211
6
0.00000
0.06963
-0.01595
7
0.00000
0.01827
0.00618
8
0.00000
0.00118
0.02936
9
0.00000
-0.00118
0.02936
10
0.00000
-0.01827
0.00618
11
0.00000
0.04372
0.01170
12
0.00000
-0.07741
-0.01572
13
0.00000
0.07741
-0.01572
14
0.00000
-0.04372
0.01170
15
0.00000
-0.00195
0.00163
16
0.00000
0.00195
0.00163
17
0.00000
0.00113
-0.03917
18
0.00000
0.02059
0.04998
19
0.00000
-0.02059
0.04998
20
0.00000
-0.00113
-0.03917
21
0.00000
-0.01522
0.00676
22
0.00000
-0.02731
-0.03942
23
0.00000
0.02731
-0.03942
24
0.00000
0.01522
0.00676
25
0.00000
-0.01794
-0.06233
26
0.00000
0.01794
-0.06233
27
0.00000
0.01061
0.02970
28
0.00000
-0.01061
0.02970
29
0.00000
0.00117
0.11656
30
0.00000
0.02425
-0.11212
31
0.00000
-0.02425
-0.11212
32
0.00000
-0.00117
0.11656
33
0.00000
0.05308
0.05196
34
0.00000
0.09080
0.02509
35
0.00000
-0.09080
0.02509
36
0.00000
-0.05308
0.05196
37
0.00000
0.02172
0.04008
38
0.00000
0.05162
0.06870
39
0.00000
-0.05162
0.06870
40
0.00000
-0.02172
0.04008
41
0.00000
-0.01509
0.19633
42
0.00000
0.01509
0.19633