Charge: 0
Inchi:1S/C22H12/c1-3-13-7-9-18-12-16-6-2-4-14-8-10-17-11-15(5-1)19(13)21(18)22(17)20(14)16/h1-12H
Electronic States
Energy
(eV)
-844.32045
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2h
Symmetry Elements
E
C2(z)
sigmah(xy)
i
Rotational Constants
(cm-1)
0.02100 b
(cm-1)
0.00820 c
(cm-1)
0.00590
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.00000
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)
0.18700
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.05501
2
0.00000
0.00000
-0.05501
3
0.00000
0.00000
-0.02491
4
0.00000
0.00000
-0.06114
5
0.00000
0.00000
-0.06114
6
0.00000
0.00000
-0.02491
7
0.00000
0.00000
-0.00336
8
0.00000
0.00000
-0.03835
9
0.00000
0.00000
-0.03835
10
0.00000
0.00000
-0.00336
11
0.00000
0.00000
0.00373
12
0.00000
0.00000
-0.06466
13
0.00000
0.00000
-0.06466
14
0.00000
0.00000
0.00373
15
0.00000
0.00000
-0.03058
16
0.00000
0.00000
-0.03058
17
0.00000
0.00000
0.07598
18
0.00000
0.00000
0.07598
19
0.00000
0.00000
0.11244
20
0.00000
0.00000
0.11244
21
0.00000
0.00000
0.06668
22
0.00000
0.00000
0.06668
23
0.00000
0.00000
-0.02219
24
0.00000
0.00000
-0.02219
25
0.00000
0.00000
0.10562
26
0.00000
0.00000
0.10562
27
0.00000
0.00000
0.17250
28
0.00000
0.00000
0.17250
29
0.00000
0.00000
-0.08311
30
0.00000
0.00000
-0.08311
31
0.00000
0.00000
-0.03316
32
0.00000
0.00000
-0.03316
33
0.00000
0.00000
0.08867
34
0.00000
0.00000
0.08867