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)
-0.14700
Eigenvectors
#
X
Y
Z
1
0.00000
-0.05153
-0.00124
2
0.00000
0.05153
-0.00124
3
0.00000
-0.02986
0.04414
4
0.00000
-0.01221
-0.02577
5
0.00000
0.01221
-0.02577
6
0.00000
0.02986
0.04414
7
0.00000
0.00109
0.00638
8
0.00000
-0.08639
-0.05120
9
0.00000
0.08639
-0.05120
10
0.00000
-0.00109
0.00638
11
0.00000
0.00182
-0.02373
12
0.00000
-0.00858
0.03857
13
0.00000
0.00858
0.03857
14
0.00000
-0.00182
-0.02373
15
0.00000
0.00126
-0.00808
16
0.00000
-0.00126
-0.00808
17
0.00000
-0.01137
-0.01898
18
0.00000
0.01573
0.00789
19
0.00000
-0.01573
0.00789
20
0.00000
0.01137
-0.01898
21
0.00000
0.02628
0.01822
22
0.00000
0.01124
-0.01491
23
0.00000
-0.01124
-0.01491
24
0.00000
-0.02628
0.01822
25
0.00000
-0.01407
-0.01791
26
0.00000
0.01407
-0.01791
27
0.00000
0.00187
0.01820
28
0.00000
-0.00187
0.01820
29
0.00000
-0.01250
-0.23422
30
0.00000
0.01660
0.20772
31
0.00000
-0.01660
0.20772
32
0.00000
0.01250
-0.23422
33
0.00000
0.20958
0.13068
34
0.00000
0.12320
0.04321
35
0.00000
-0.12320
0.04321
36
0.00000
-0.20958
0.13068
37
0.00000
0.11078
0.08456
38
0.00000
0.14780
0.13877
39
0.00000
-0.14780
0.13877
40
0.00000
-0.11078
0.08456
41
0.00000
-0.01516
-0.03217
42
0.00000
0.01516
-0.03217