Charge: 1
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-3,5-8H,4H2/q+1
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)
0.00000
Diff mu Z
(Debye)
-0.19000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.14920
2
0.00000
-0.04939
-0.05794
3
0.00000
0.04939
-0.05794
4
0.00000
0.10341
-0.02658
5
0.00000
-0.10341
-0.02659
6
0.00000
0.01147
0.05751
7
0.00000
-0.01147
0.05750
8
0.00000
0.00567
0.06741
9
0.00000
-0.00567
0.06741
10
0.00000
0.00000
0.07132
11
0.00000
0.00000
-0.14889
12
0.00000
-0.01053
0.01489
13
0.00000
0.01053
0.01489
14
0.00000
0.09337
-0.06884
15
0.00000
-0.09338
-0.06884
16
0.00000
0.00344
0.07502
17
0.00000
-0.00344
0.07502
18
0.00000
0.00000
0.07211