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)
-385.33849
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09497 b
(cm-1)
0.04175 c
(cm-1)
0.02900
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.45804
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)
-0.75000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00020
2
0.00000
-0.00024
0.00019
3
0.00000
0.00024
0.00019
4
0.00000
0.00043
-0.00040
5
0.00000
-0.00043
-0.00040
6
0.00000
0.00055
0.00313
7
0.00000
-0.00055
0.00313
8
0.00000
-0.04791
-0.01392
9
0.00000
0.04791
-0.01392
10
0.00000
0.00000
-0.05384
11
0.00000
0.00000
-0.00240
12
0.00000
-0.00343
-0.00317
13
0.00000
0.00343
-0.00317
14
0.00000
-0.00709
-0.00015
15
0.00000
0.00709
-0.00015
16
0.00000
0.50819
0.17047
17
0.00000
-0.50818
0.17046
18
0.00000
0.00000
0.56869