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)
0.00000
Diff mu Y
(Debye)
-0.87000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00062
0.00000
2
0.00000
-0.03712
0.03188
3
0.00000
-0.03712
-0.03188
4
0.00000
0.02720
-0.00464
5
0.00000
0.02720
0.00464
6
0.00000
0.00039
-0.00052
7
0.00000
0.00039
0.00052
8
0.00000
-0.00098
0.00030
9
0.00000
-0.00098
-0.00030
10
0.00000
0.00065
0.00000
11
0.00000
-0.00476
0.00000
12
0.00000
0.45064
0.36725
13
0.00000
0.45064
-0.36725
14
0.00000
-0.33923
0.07360
15
0.00000
-0.33923
-0.07360
16
0.00000
0.00828
0.00217
17
0.00000
0.00828
-0.00217
18
0.00000
0.00056
0.00000