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)
0.18100
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00003
0.00000
0.00000
2
-0.00003
0.00000
0.00000
3
0.00060
0.00000
0.00000
4
-0.00018
0.00000
0.00000
5
-0.00018
0.00000
0.00000
6
0.00060
0.00000
0.00000
7
-0.01256
0.00000
0.00000
8
0.00505
0.00000
0.00000
9
0.00505
0.00000
0.00000
10
-0.01256
0.00000
0.00000
11
0.02140
0.00000
0.00000
12
-0.00324
0.00000
0.00000
13
-0.00324
0.00000
0.00000
14
0.02140
0.00000
0.00000
15
0.00938
0.00000
0.00000
16
0.00938
0.00000
0.00000
17
-0.03408
0.00000
0.00000
18
0.00425
0.00000
0.00000
19
0.00425
0.00000
0.00000
20
-0.03408
0.00000
0.00000
21
0.02767
0.00000
0.00000
22
-0.01340
0.00000
0.00000
23
-0.01340
0.00000
0.00000
24
0.02767
0.00000
0.00000
25
-0.08220
0.00000
0.00000
26
-0.08220
0.00000
0.00000
27
0.06223
0.00000
0.00000
28
0.06223
0.00000
0.00000
29
0.17355
0.00000
0.00000
30
-0.02869
0.00000
0.00000
31
-0.02869
0.00000
0.00000
32
0.17355
0.00000
0.00000
33
-0.10748
0.00000
0.00000
34
0.07631
0.00000
0.00000
35
0.07631
0.00000
0.00000
36
-0.10748
0.00000
0.00000
37
-0.35231
0.00000
0.00000
38
0.01504
0.00000
0.00000
39
0.01504
0.00000
0.00000
40
-0.35231
0.00000
0.00000
41
0.40344
0.00000
0.00000
42
0.40344
0.00000
0.00000