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)
-0.10500
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.01375
0.00000
0.03127
2
0.01375
0.00000
-0.03127
3
-0.00444
0.00000
0.05116
4
0.02582
0.00000
0.01722
5
-0.00444
0.00000
-0.05116
6
0.02582
0.00000
-0.01722
7
-0.00328
0.00000
0.02123
8
-0.06203
0.00000
-0.00463
9
-0.00328
0.00000
-0.02123
10
-0.06203
0.00000
0.00463
11
0.01096
0.00000
0.00592
12
0.01690
0.00000
-0.05549
13
0.01096
0.00000
-0.00592
14
0.01690
0.00000
0.05549
15
0.00184
0.00000
-0.00139
16
0.05290
0.00000
0.05624
17
0.00184
0.00000
0.00139
18
0.05290
0.00000
-0.05624
19
-0.00044
0.00000
-0.04075
20
-0.00044
0.00000
0.04075
21
-0.01904
0.00000
-0.02340
22
-0.01904
0.00000
0.02340
23
0.00056
0.00000
0.06887
24
0.05379
0.00000
0.31022
25
0.00056
0.00000
-0.06887
26
0.05379
0.00000
-0.31022
27
-0.00399
0.00000
-0.00079
28
-0.05883
0.00000
-0.10617
29
-0.00399
0.00000
0.00079
30
-0.05883
0.00000
0.10617
31
-0.31340
0.00000
0.12406
32
-0.31340
0.00000
-0.12406
33
-0.07040
0.00000
-0.08401
34
-0.07040
0.00000
0.08401