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)
-1.16800
Eigenvectors
#
X
Y
Z
1
0.00000
-0.00020
-0.00035
2
0.00000
0.00020
-0.00035
3
0.00000
-0.00050
0.00009
4
0.00000
0.00050
0.00009
5
0.00000
-0.00033
-0.00006
6
0.00000
0.00033
-0.00006
7
0.00000
0.00010
-0.00116
8
0.00000
-0.00010
-0.00116
9
0.00000
-0.01525
-0.02361
10
0.00000
0.01525
-0.02361
11
0.00000
0.00544
-0.00963
12
0.00000
-0.00544
-0.00963
13
0.00000
-0.00914
-0.01865
14
0.00000
0.00914
-0.01865
15
0.00000
-0.01446
0.00067
16
0.00000
0.01446
0.00067
17
0.00000
-0.02942
-0.00013
18
0.00000
0.02942
-0.00013
19
0.00000
-0.01659
0.03043
20
0.00000
0.01659
0.03043
21
0.00000
0.16275
0.00086
22
0.00000
-0.16275
0.00086
23
0.00000
-0.07095
0.11514
24
0.00000
0.07095
0.11514
25
0.00000
0.11583
0.20879
26
0.00000
-0.11583
0.20879
27
0.00000
0.16125
0.27756
28
0.00000
-0.16125
0.27756
29
0.00000
0.32198
-0.00627
30
0.00000
-0.32198
-0.00627
31
0.00000
0.18952
-0.32944
32
0.00000
-0.18952
-0.32944