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)
2.02700
Diff mu Y
(Debye)
0.85000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.01642
-0.00112
0.00000
2
-0.01642
-0.00112
0.00000
3
0.06429
0.01292
0.00000
4
0.00479
-0.05496
0.00000
5
0.00479
-0.05496
0.00000
6
0.06429
0.01292
0.00000
7
-0.04089
-0.05624
0.00000
8
0.00280
0.06133
0.00000
9
0.00280
0.06133
0.00000
10
-0.04089
-0.05624
0.00000
11
-0.06589
-0.00991
0.00000
12
-0.00539
0.04066
0.00000
13
-0.00539
0.04066
0.00000
14
-0.06589
-0.00991
0.00000
15
0.01534
-0.01502
0.00000
16
0.01534
-0.01502
0.00000
17
0.07551
0.03599
0.00000
18
0.07551
0.03599
0.00000
19
-0.06490
-0.00823
0.00000
20
-0.06490
-0.00823
0.00000
21
0.02255
0.03550
0.00000
22
0.02255
0.03550
0.00000
23
0.01691
-0.01814
0.00000
24
0.01691
-0.01814
0.00000
25
-0.09903
-0.11398
0.00000
26
-0.09903
-0.11398
0.00000
27
0.08271
-0.06605
0.00000
28
0.08271
-0.06605
0.00000
29
0.01353
-0.07801
0.00000
30
0.01353
-0.07801
0.00000
31
0.03760
-0.14143
0.00000
32
0.03760
-0.14143
0.00000
33
0.04582
-0.06976
0.00000
34
0.04582
-0.06976
0.00000