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)
0.35100
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.14418
0.00000
2
0.00000
-0.07591
-0.00864
3
0.00000
-0.07591
0.00864
4
0.00000
0.04385
0.08146
5
0.00000
0.04385
-0.08146
6
0.00000
-0.03046
-0.09236
7
0.00000
-0.03046
0.09236
8
0.00000
-0.00906
-0.01916
9
0.00000
-0.00906
0.01916
10
0.00000
0.03161
0.00000
11
0.00000
-0.22383
0.00000
12
0.00000
-0.01268
-0.07919
13
0.00000
-0.01268
0.07919
14
0.00000
-0.01428
-0.20500
15
0.00000
-0.01428
0.20500
16
0.00000
-0.03369
0.03556
17
0.00000
-0.03370
-0.03556
18
0.00000
-0.04360
0.00000