Charge: 1
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-7H,8H2/q+1
Electronic States
Energy
(eV)
-385.85306
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09480 b
(cm-1)
0.04163 c
(cm-1)
0.02893
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.43892
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.16400
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
-0.01866
0.00000
2
0.00000
0.04019
0.02307
3
0.00000
0.04019
-0.02307
4
0.00000
0.01740
0.03026
5
0.00000
0.01740
-0.03026
6
0.00000
-0.08383
-0.08494
7
0.00000
-0.08383
0.08495
8
0.00000
0.04749
0.00116
9
0.00000
0.04749
-0.00116
10
0.00000
-0.04707
0.00000
11
0.00000
0.22442
0.00000
12
0.00000
-0.19030
0.26197
13
0.00000
-0.19031
-0.26197
14
0.00000
0.06134
0.22786
15
0.00000
0.06135
-0.22787
16
0.00000
0.00828
0.12428
17
0.00000
0.00828
-0.12430
18
0.00000
0.29354
0.00000