Charge: 1
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-3,5-8H,4H2/q+1
Electronic States
Energy
(eV)
-385.87618
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09453 b
(cm-1)
0.04092 c
(cm-1)
0.02856
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.38427
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-0.11800
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.02981
0.00000
0.00000
2
-0.06772
0.00000
0.00000
3
-0.06772
0.00000
0.00000
4
0.05029
0.00000
0.00000
5
0.05029
0.00000
0.00000
6
-0.00452
0.00000
0.00000
7
-0.00452
0.00000
0.00000
8
0.00707
0.00000
0.00000
9
0.00707
0.00000
0.00000
10
-0.00397
0.00000
0.00000
11
-0.22680
0.00000
0.00000
12
0.50514
0.00000
0.00000
13
0.50514
0.00000
0.00000
14
-0.35191
0.00000
0.00000
15
-0.35191
0.00000
0.00000
16
-0.02061
0.00000
0.00000
17
-0.02061
0.00000
0.00000
18
0.00806
0.00000
0.00000