Charge: -1
Inchi:1S/C20H12/c1-2-8-16-15(7-1)17-9-3-5-13-11-12-14-6-4-10-18(16)20(14)19(13)17/h1-12H/q-1
Electronic States
Energy
(eV)
-768.17180
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.01701 b
(cm-1)
0.01294 c
(cm-1)
0.00735
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.49136
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
-0.00277
0.00000
0.00000
2
-0.00277
0.00000
0.00000
3
-0.00460
0.00000
0.00000
4
-0.00460
0.00000
0.00000
5
-0.00943
0.00000
0.00000
6
-0.00943
0.00000
0.00000
7
0.00040
0.00000
0.00000
8
0.00040
0.00000
0.00000
9
0.00620
0.00000
0.00000
10
0.00620
0.00000
0.00000
11
0.04636
0.00000
0.00000
12
0.04636
0.00000
0.00000
13
0.05567
0.00000
0.00000
14
0.05567
0.00000
0.00000
15
-0.08512
0.00000
0.00000
16
-0.08512
0.00000
0.00000
17
0.00935
0.00000
0.00000
18
0.00935
0.00000
0.00000
19
-0.00764
0.00000
0.00000
20
-0.00764
0.00000
0.00000
21
0.45409
0.00000
0.00000
22
0.45409
0.00000
0.00000
23
-0.22825
0.00000
0.00000
24
-0.22825
0.00000
0.00000
25
-0.28081
0.00000
0.00000
26
-0.28081
0.00000
0.00000
27
-0.03063
0.00000
0.00000
28
-0.03063
0.00000
0.00000
29
-0.06009
0.00000
0.00000
30
-0.06009
0.00000
0.00000
31
0.04536
0.00000
0.00000
32
0.04536
0.00000
0.00000