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)
-0.41400
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.06161
2
0.00000
-0.01054
0.01170
3
0.00000
0.01054
0.01170
4
0.00000
0.03358
-0.00710
5
0.00000
-0.03358
-0.00710
6
0.00000
-0.00002
-0.00132
7
0.00000
0.00002
-0.00132
8
0.00000
0.00075
0.00026
9
0.00000
-0.00075
0.00026
10
0.00000
0.00000
-0.00006
11
0.00000
0.00000
0.72621
12
0.00000
-0.14431
-0.12123
13
0.00000
0.14431
-0.12124
14
0.00000
-0.38789
0.08234
15
0.00000
0.38789
0.08234
16
0.00000
-0.00760
-0.00108
17
0.00000
0.00760
-0.00108
18
0.00000
0.00000
0.00387