Charge: 2
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-3,5-8H,4H2/q+2
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)
-0.15400
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.14776
2
0.00000
0.05018
0.05889
3
0.00000
-0.05018
0.05889
4
0.00000
-0.10093
0.02974
5
0.00000
0.10093
0.02974
6
0.00000
-0.00856
-0.05856
7
0.00000
0.00856
-0.05856
8
0.00000
-0.00589
-0.06909
9
0.00000
0.00589
-0.06909
10
0.00000
0.00000
-0.07251
11
0.00000
0.00000
0.14627
12
0.00000
0.00750
-0.01096
13
0.00000
-0.00750
-0.01096
14
0.00000
-0.09015
0.06987
15
0.00000
0.09015
0.06987
16
0.00000
-0.00295
-0.07903
17
0.00000
0.00295
-0.07903
18
0.00000
0.00000
-0.07291