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)
-0.16300
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.03563
0.00000
2
0.00000
0.04313
-0.05791
3
0.00000
0.04313
0.05791
4
0.00000
-0.12430
0.01102
5
0.00000
-0.12430
-0.01102
6
0.00000
-0.00704
-0.04520
7
0.00000
-0.00704
0.04520
8
0.00000
0.06820
0.09292
9
0.00000
0.06820
-0.09292
10
0.00000
0.01636
0.00000
11
0.00000
-0.07571
0.00000
12
0.00000
0.10252
-0.01872
13
0.00000
0.10252
0.01872
14
0.00000
-0.12530
-0.01083
15
0.00000
-0.12530
0.01083
16
0.00000
0.06361
0.10859
17
0.00000
0.06361
-0.10859
18
0.00000
-0.14847
0.00000