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)
0.09400
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00727
2
0.00000
0.05271
0.03763
3
0.00000
-0.05271
0.03763
4
0.00000
0.02944
-0.03598
5
0.00000
-0.02944
-0.03598
6
0.00000
-0.04994
-0.00162
7
0.00000
0.04994
-0.00162
8
0.00000
-0.01497
-0.01475
9
0.00000
0.01497
-0.01475
10
0.00000
0.00000
0.01715
11
0.00000
0.00000
0.00538
12
0.00000
-0.33702
0.38611
13
0.00000
0.33702
0.38611
14
0.00000
-0.03554
-0.34436
15
0.00000
0.03554
-0.34436
16
0.00000
-0.01312
-0.02331
17
0.00000
0.01313
-0.02328
18
0.00000
0.00001
0.01741