Charge: 2
Inchi:1S/C22H12/c1-3-13-7-9-15-11-12-16-10-8-14-4-2-6-18-17(5-1)19(13)21(15)22(16)20(14)18/h1-12H/q+2
Electronic States
Energy
(eV)
-844.31798
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.40100
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.01147
0.00000
-0.04407
2
-0.01147
0.00000
0.04407
3
0.05137
0.00000
0.04080
4
0.00591
0.00000
0.05539
5
0.05137
0.00000
-0.04080
6
0.00591
0.00000
-0.05539
7
-0.06855
0.00000
0.06482
8
-0.02017
0.00000
-0.02182
9
-0.06855
0.00000
-0.06482
10
-0.02017
0.00000
0.02182
11
0.02552
0.00000
-0.00565
12
-0.00027
0.00000
0.00684
13
0.02552
0.00000
0.00565
14
-0.00027
0.00000
-0.00684
15
0.01994
0.00000
-0.03261
16
0.02996
0.00000
-0.03045
17
0.01994
0.00000
0.03261
18
0.02996
0.00000
0.03045
19
-0.00347
0.00000
-0.05754
20
-0.00347
0.00000
0.05754
21
-0.07462
0.00000
0.00611
22
-0.07462
0.00000
-0.00611
23
0.02217
0.00000
-0.07707
24
0.03287
0.00000
-0.04788
25
0.02217
0.00000
0.07707
26
0.03287
0.00000
0.04788
27
0.21301
0.00000
0.09970
28
0.05583
0.00000
0.03835
29
0.21301
0.00000
-0.09970
30
0.05583
0.00000
-0.03835
31
0.15558
0.00000
-0.11807
32
0.15558
0.00000
0.11807
33
0.06644
0.00000
-0.01896
34
0.06644
0.00000
0.01896