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)
-844.54925
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2h
Symmetry Elements
E
C2(z)
sigmah(xy)
i
Rotational Constants
(cm-1)
0.02091 b
(cm-1)
0.00821 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)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.05641
0.00226
0.00000
2
0.05641
-0.00227
0.00000
3
0.01103
0.01550
0.00000
4
0.07992
-0.04449
0.00000
5
-0.07992
0.04449
0.00000
6
-0.01104
-0.01550
0.00000
7
0.01216
0.09430
0.00000
8
-0.01320
-0.00897
0.00000
9
0.01320
0.00897
0.00000
10
-0.01216
-0.09429
0.00000
11
0.00629
-0.02771
0.00000
12
-0.03890
0.00577
0.00000
13
0.03890
-0.00577
0.00000
14
-0.00629
0.02771
0.00000
15
0.00224
0.00468
0.00000
16
-0.00224
-0.00468
0.00000
17
-0.00152
0.00339
0.00000
18
0.00152
-0.00339
0.00000
19
-0.01425
-0.01134
0.00000
20
0.01425
0.01134
0.00000
21
-0.02536
-0.00680
0.00000
22
0.02536
0.00680
0.00000
23
-0.00790
-0.00781
0.00000
24
0.00788
0.00779
0.00000
25
0.04991
0.04756
0.00000
26
-0.04993
-0.04759
0.00000
27
0.09931
-0.05114
0.00000
28
-0.09932
0.05114
0.00000
29
0.09362
-0.25025
0.00000
30
-0.09362
0.25024
0.00000
31
-0.03017
0.18726
0.00000
32
0.03017
-0.18727
0.00000
33
0.02654
-0.27834
0.00000
34
-0.02654
0.27834
0.00000