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)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00230
0.00000
0.00000
2
0.00230
0.00000
0.00000
3
0.02502
0.00000
0.00000
4
-0.02502
0.00000
0.00000
5
-0.02606
0.00000
0.00000
6
0.02606
0.00000
0.00000
7
0.04582
0.00000
0.00000
8
-0.04582
0.00000
0.00000
9
-0.01747
0.00000
0.00000
10
0.01747
0.00000
0.00000
11
0.00210
0.00000
0.00000
12
-0.00210
0.00000
0.00000
13
-0.05165
0.00000
0.00000
14
0.05165
0.00000
0.00000
15
-0.04076
0.00000
0.00000
16
0.04076
0.00000
0.00000
17
0.13663
0.00000
0.00000
18
-0.13663
0.00000
0.00000
19
0.08149
0.00000
0.00000
20
-0.08149
0.00000
0.00000
21
-0.06517
0.00000
0.00000
22
0.06517
0.00000
0.00000
23
0.00308
0.00000
0.00000
24
-0.00308
0.00000
0.00000
25
-0.07943
0.00000
0.00000
26
0.07943
0.00000
0.00000
27
-0.03258
0.00000
0.00000
28
0.03258
0.00000
0.00000
29
0.25254
0.00000
0.00000
30
-0.25254
0.00000
0.00000
31
0.15338
0.00000
0.00000
32
-0.15338
0.00000
0.00000