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)
-385.60867
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09587 b
(cm-1)
0.04112 c
(cm-1)
0.02878
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.18402
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)
-0.12200
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.05376
2
0.00000
-0.01175
0.01264
3
0.00000
0.01175
0.01264
4
0.00000
0.03956
-0.00860
5
0.00000
-0.03956
-0.00860
6
0.00000
-0.00037
-0.00116
7
0.00000
0.00037
-0.00116
8
0.00000
0.00093
0.00047
9
0.00000
-0.00093
0.00047
10
0.00000
0.00000
-0.00334
11
0.00000
0.00000
0.62751
12
0.00000
-0.15547
-0.12872
13
0.00000
0.15547
-0.12872
14
0.00000
-0.45533
0.09978
15
0.00000
0.45533
0.09978
16
0.00000
-0.01144
-0.00376
17
0.00000
0.01144
-0.00376
18
0.00000
0.00000
0.03782