Charge: 1
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-7H,8H2/q+1
Electronic States
Energy
(eV)
-385.86921
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09470 b
(cm-1)
0.04162 c
(cm-1)
0.02891
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.41127
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
-0.56400
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00035
0.00000
2
0.00000
-0.00031
-0.00011
3
0.00000
-0.00031
0.00012
4
0.00000
-0.00130
0.00011
5
0.00000
-0.00130
-0.00011
6
0.00000
0.00094
-0.00293
7
0.00000
0.00094
0.00293
8
0.00000
-0.05659
-0.01938
9
0.00000
-0.05659
0.01938
10
0.00000
0.00476
0.00000
11
0.00000
0.00012
0.00000
12
0.00000
0.00240
0.00241
13
0.00000
0.00240
-0.00241
14
0.00000
0.01358
-0.00172
15
0.00000
0.01358
0.00172
16
0.00000
0.63778
0.21513
17
0.00000
0.63777
-0.21513
18
0.00000
-0.00504
0.00000