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)
-385.87618
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)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
-1.15100
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.01399
2
0.00000
0.02212
-0.02824
3
0.00000
-0.02212
-0.02824
4
0.00000
0.00225
0.01697
5
0.00000
-0.00225
0.01697
6
0.00000
-0.03019
0.11762
7
0.00000
0.03019
0.11762
8
0.00000
-0.09532
-0.01682
9
0.00000
0.09532
-0.01682
10
0.00000
0.00000
-0.09109
11
0.00000
0.00000
0.01072
12
0.00000
0.00596
-0.06628
13
0.00000
-0.00596
-0.06628
14
0.00000
-0.06793
-0.27244
15
0.00000
0.06793
-0.27244
16
0.00000
-0.04657
-0.21983
17
0.00000
0.04657
-0.21983
18
0.00000
0.00000
-0.10757