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)
-0.01800
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.02830
0.00000
0.04620
2
-0.02830
0.00000
-0.04620
3
0.01762
0.00000
-0.01167
4
0.02021
0.00000
-0.03549
5
0.01762
0.00000
0.01167
6
0.02021
0.00000
0.03549
7
-0.06639
0.00000
-0.06457
8
0.00294
0.00000
0.01895
9
-0.06639
0.00000
0.06457
10
0.00294
0.00000
-0.01895
11
-0.00851
0.00000
0.00243
12
0.01087
0.00000
-0.00267
13
-0.00851
0.00000
-0.00243
14
0.01087
0.00000
0.00267
15
0.02642
0.00000
-0.00628
16
0.01583
0.00000
0.00589
17
0.02642
0.00000
0.00628
18
0.01583
0.00000
-0.00589
19
0.00007
0.00000
0.00703
20
0.00007
0.00000
-0.00703
21
-0.01787
0.00000
-0.04805
22
-0.01787
0.00000
0.04805
23
0.02856
0.00000
0.15553
24
0.02209
0.00000
-0.23400
25
0.02856
0.00000
-0.15553
26
0.02209
0.00000
0.23400
27
0.18878
0.00000
0.11021
28
0.00621
0.00000
-0.00609
29
0.18878
0.00000
-0.11021
30
0.00621
0.00000
0.00609
31
-0.19366
0.00000
0.12558
32
-0.19366
0.00000
-0.12558
33
0.27079
0.00000
0.16814
34
0.27079
0.00000
-0.16814