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)
-385.33849
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09497 b
(cm-1)
0.04175 c
(cm-1)
0.02900
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.45804
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
-0.63100
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
-0.00016
0.00000
2
0.00000
0.01607
-0.01161
3
0.00000
0.01607
0.01161
4
0.00000
-0.05244
0.01060
5
0.00000
-0.05245
-0.01060
6
0.00000
0.00047
0.00172
7
0.00000
0.00047
-0.00172
8
0.00000
0.00093
0.00033
9
0.00000
0.00093
-0.00033
10
0.00000
-0.00012
0.00000
11
0.00000
-0.00048
-0.00001
12
0.00000
-0.18980
-0.15351
13
0.00000
-0.18981
0.15351
14
0.00000
0.61733
-0.12853
15
0.00000
0.61735
0.12853
16
0.00000
-0.00905
-0.00137
17
0.00000
-0.00905
0.00137
18
0.00000
-0.00023
0.00000