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)
-385.71438
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09692 b
(cm-1)
0.04154 c
(cm-1)
0.02908
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.16806
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)
1.19300
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.05308
2
0.00000
0.03245
-0.02537
3
0.00000
-0.03245
-0.02537
4
0.00000
-0.01516
0.00358
5
0.00000
0.01516
0.00358
6
0.00000
0.00085
0.00002
7
0.00000
-0.00085
0.00002
8
0.00000
0.00952
0.00226
9
0.00000
-0.00952
0.00226
10
0.00000
0.00000
0.01174
11
0.00000
0.00000
0.61042
12
0.00000
0.36741
0.29657
13
0.00000
-0.36741
0.29657
14
0.00000
0.16832
-0.03820
15
0.00000
-0.16832
-0.03820
16
0.00000
-0.09060
-0.02949
17
0.00000
0.09060
-0.02949
18
0.00000
0.00000
-0.11113