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)
0.39200
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
-0.04242
0.00000
2
0.00000
0.02895
-0.01561
3
0.00000
0.02895
0.01561
4
0.00000
-0.02522
-0.02969
5
0.00000
-0.02522
0.02969
6
0.00000
0.07039
-0.07701
7
0.00000
0.07039
0.07701
8
0.00000
-0.04667
-0.01809
9
0.00000
-0.04667
0.01809
10
0.00000
-0.03104
0.00000
11
0.00000
-0.39151
0.00000
12
0.00000
0.12996
-0.10871
13
0.00000
0.12996
0.10871
14
0.00000
-0.00457
0.04553
15
0.00000
-0.00457
-0.04553
16
0.00000
0.06682
-0.38907
17
0.00000
0.06682
0.38907
18
0.00000
0.22805
0.00000