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)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
-0.00800
Eigenvectors
#
X
Y
Z
1
-0.00072
0.00000
0.00002
2
0.00072
0.00000
0.00002
3
0.00005
0.00000
-0.00006
4
-0.00018
0.00000
0.00013
5
-0.00005
0.00000
-0.00006
6
0.00018
0.00000
0.00013
7
-0.00034
0.00000
-0.00020
8
-0.00018
0.00000
-0.00037
9
0.00034
0.00000
-0.00020
10
0.00018
0.00000
-0.00037
11
-0.00516
0.00000
0.00751
12
0.01067
0.00000
-0.01470
13
0.00516
0.00000
0.00751
14
-0.01067
0.00000
-0.01470
15
0.02602
0.00000
-0.00010
16
-0.04769
0.00000
-0.00048
17
-0.02602
0.00000
-0.00010
18
0.04769
0.00000
-0.00048
19
-0.00463
0.00000
0.00686
20
0.00463
0.00000
0.00686
21
-0.00066
0.00000
-0.00075
22
0.00066
0.00000
-0.00075
23
-0.29836
0.00000
0.00305
24
0.54690
0.00000
0.00694
25
0.29836
0.00000
0.00305
26
-0.54690
0.00000
0.00694
27
0.05587
0.00000
-0.09477
28
-0.11199
0.00000
0.18546
29
-0.05587
0.00000
-0.09477
30
0.11199
0.00000
0.18546
31
-0.00082
0.00000
0.00253
32
0.00082
0.00000
0.00253
33
0.04418
0.00000
-0.07779
34
-0.04418
0.00000
-0.07779