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)
-0.33700
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00037
0.00000
-0.00013
2
0.00037
0.00000
0.00013
3
0.00003
0.00000
-0.00016
4
-0.00011
0.00000
0.00009
5
0.00003
0.00000
0.00016
6
-0.00011
0.00000
-0.00009
7
-0.00042
0.00000
-0.00033
8
-0.00070
0.00000
-0.00159
9
-0.00042
0.00000
0.00033
10
-0.00070
0.00000
0.00159
11
0.01388
0.00000
-0.02159
12
-0.00313
0.00000
0.00435
13
0.01388
0.00000
0.02159
14
-0.00313
0.00000
-0.00435
15
-0.04872
0.00000
0.00035
16
0.01268
0.00000
0.00016
17
-0.04872
0.00000
-0.00035
18
0.01268
0.00000
-0.00016
19
-0.00584
0.00000
0.01104
20
-0.00584
0.00000
-0.01104
21
0.00020
0.00000
-0.00176
22
0.00020
0.00000
0.00176
23
0.56028
0.00000
-0.00201
24
-0.14488
0.00000
-0.00298
25
0.56028
0.00000
0.00201
26
-0.14488
0.00000
0.00298
27
-0.15362
0.00000
0.26728
28
0.03380
0.00000
-0.05651
29
-0.15362
0.00000
-0.26728
30
0.03380
0.00000
0.05651
31
0.00870
0.00000
0.01760
32
0.00870
0.00000
-0.01760
33
0.07390
0.00000
-0.12520
34
0.07390
0.00000
0.12520