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)
0.22900
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.13143
2
0.00000
-0.10223
0.06786
3
0.00000
0.10223
0.06786
4
0.00000
-0.07771
0.03451
5
0.00000
0.07771
0.03451
6
0.00000
-0.01643
-0.02873
7
0.00000
0.01643
-0.02873
8
0.00000
-0.06113
-0.02346
9
0.00000
0.06113
-0.02346
10
0.00000
0.00000
0.04750
11
0.00000
0.00000
-0.12823
12
0.00000
0.06732
0.10687
13
0.00000
-0.06732
0.10687
14
0.00000
-0.09992
-0.07702
15
0.00000
0.09992
-0.07702
16
0.00000
-0.04145
-0.08671
17
0.00000
0.04145
-0.08671
18
0.00000
0.00000
0.04655