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)
0.00000
Diff mu Z
(Debye)
-0.51400
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00013
2
0.00000
-0.00027
0.00023
3
0.00000
0.00027
0.00023
4
0.00000
0.00057
-0.00036
5
0.00000
-0.00057
-0.00036
6
0.00000
0.00028
0.00308
7
0.00000
-0.00028
0.00308
8
0.00000
-0.05049
-0.01461
9
0.00000
0.05049
-0.01461
10
0.00000
0.00000
-0.04861
11
0.00000
0.00000
-0.00161
12
0.00000
-0.00367
-0.00347
13
0.00000
0.00366
-0.00347
14
0.00000
-0.00821
0.00009
15
0.00000
0.00821
0.00009
16
0.00000
0.53770
0.17868
17
0.00000
-0.53772
0.17868
18
0.00000
0.00000
0.50573