Charge: -1
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-1
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)
0.11100
Eigenvectors
#
X
Y
Z
1
-0.01228
0.00000
-0.02231
2
0.01228
0.00000
-0.02231
3
-0.01243
0.00000
0.02021
4
0.00907
0.00000
-0.04734
5
0.01243
0.00000
0.02021
6
-0.00907
0.00000
-0.04734
7
-0.00807
0.00000
0.04334
8
0.06822
0.00000
0.05852
9
0.00807
0.00000
0.04334
10
-0.06822
0.00000
0.05852
11
0.02436
0.00000
-0.00680
12
-0.01810
0.00000
0.05416
13
-0.02436
0.00000
-0.00680
14
0.01810
0.00000
0.05416
15
-0.00251
0.00000
-0.00204
16
-0.08321
0.00000
-0.04472
17
0.00251
0.00000
-0.00204
18
0.08321
0.00000
-0.04472
19
0.02227
0.00000
-0.02974
20
-0.02227
0.00000
-0.02974
21
-0.02920
0.00000
-0.01974
22
0.02920
0.00000
-0.01974
23
-0.00367
0.00000
0.10580
24
-0.08674
0.00000
-0.25882
25
0.00367
0.00000
0.10580
26
0.08674
0.00000
-0.25882
27
-0.01797
0.00000
-0.03123
28
0.02928
0.00000
0.08987
29
0.01797
0.00000
-0.03123
30
-0.02928
0.00000
0.08987
31
0.17111
0.00000
0.01003
32
-0.17111
0.00000
0.01003
33
0.15337
0.00000
0.04226
34
-0.15337
0.00000
0.04226