Charge: 2
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-7H,8H2/q+2
Electronic States
Energy
(eV)
-385.85306
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09480 b
(cm-1)
0.04163 c
(cm-1)
0.02893
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.43892
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.21400
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00127
0.00000
2
0.00000
0.06289
-0.10947
3
0.00000
0.06289
0.10947
4
0.00000
0.03107
0.10078
5
0.00000
0.03108
-0.10078
6
0.00000
0.02249
0.04170
7
0.00000
0.02249
-0.04171
8
0.00000
-0.06353
-0.01544
9
0.00000
-0.06353
0.01543
10
0.00000
-0.08775
0.00000
11
0.00000
-0.12818
0.00000
12
0.00000
0.03801
0.13999
13
0.00000
0.03800
-0.13999
14
0.00000
0.02948
0.08770
15
0.00000
0.02948
-0.08770
16
0.00000
-0.08653
0.05521
17
0.00000
-0.08653
-0.05521
18
0.00000
-0.06445
0.00000